Organoheterocyclic compounds
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5-(2-furyl)nicotinic acid, 97%, Thermo Scientific™
CAS: 857283-84-2 Molecular Formula: C10H7NO3 Molecular Weight (g/mol): 189.17 MDL Number: MFCD06410257 InChI Key: YAIWRLRMUNJGCX-UHFFFAOYSA-N PubChem CID: 23004860 IUPAC Name: 5-(furan-2-yl)pyridine-3-carboxylic acid SMILES: OC(=O)C1=CN=CC(=C1)C1=CC=CO1
| PubChem CID | 23004860 |
|---|---|
| CAS | 857283-84-2 |
| Molecular Weight (g/mol) | 189.17 |
| MDL Number | MFCD06410257 |
| SMILES | OC(=O)C1=CN=CC(=C1)C1=CC=CO1 |
| IUPAC Name | 5-(furan-2-yl)pyridine-3-carboxylic acid |
| InChI Key | YAIWRLRMUNJGCX-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO3 |
2,1,3-Benzothiadiazole-4-sulfonyl chloride, 97%, Thermo Scientific™
CAS: 73713-79-8 Molecular Formula: C6H3ClN2O2S2 Molecular Weight (g/mol): 234.67 MDL Number: MFCD00068049 InChI Key: CXAICGCTHOWKPP-UHFFFAOYSA-N Synonym: benzo c 1,2,5 thiadiazole-4-sulfonyl chloride,benzo 2,1,3 thiadiazole-4-sulfonyl chloride,2,1,3-benzothiadiazole-4-sulphonyl chloride,2,1,3-benzothiadiazol-4-sulfonyl chloride,4-chlorosulfonyl-2,1,3-benzothiadiazole,2,1,3-benzothiadiazole, 4-chlorosulfonyl,2,1,3-benzothiadiazole-4-sulfonylchloride,benzo-2,1,3-thiadiazole-4-sulfonyl chloride,2??,1,3-benzothiadiazole-4-sulfonyl chloride,benzo-2,1,3-thiadiazole-4-sulphonyl chloride PubChem CID: 2735459 IUPAC Name: 2,1,3-benzothiadiazole-4-sulfonyl chloride SMILES: ClS(=O)(=O)C1=CC=CC2=NSN=C12
| PubChem CID | 2735459 |
|---|---|
| CAS | 73713-79-8 |
| Molecular Weight (g/mol) | 234.67 |
| MDL Number | MFCD00068049 |
| SMILES | ClS(=O)(=O)C1=CC=CC2=NSN=C12 |
| Synonym | benzo c 1,2,5 thiadiazole-4-sulfonyl chloride,benzo 2,1,3 thiadiazole-4-sulfonyl chloride,2,1,3-benzothiadiazole-4-sulphonyl chloride,2,1,3-benzothiadiazol-4-sulfonyl chloride,4-chlorosulfonyl-2,1,3-benzothiadiazole,2,1,3-benzothiadiazole, 4-chlorosulfonyl,2,1,3-benzothiadiazole-4-sulfonylchloride,benzo-2,1,3-thiadiazole-4-sulfonyl chloride,2??,1,3-benzothiadiazole-4-sulfonyl chloride,benzo-2,1,3-thiadiazole-4-sulphonyl chloride |
| IUPAC Name | 2,1,3-benzothiadiazole-4-sulfonyl chloride |
| InChI Key | CXAICGCTHOWKPP-UHFFFAOYSA-N |
| Molecular Formula | C6H3ClN2O2S2 |
4-chloro-5-(2-thienyl)thieno[2,3-d]pyrimidine, 97%, Thermo Scientific™
CAS: 189681-04-7 Molecular Formula: C10H5ClN2S2 Molecular Weight (g/mol): 252.73 MDL Number: MFCD00174019 InChI Key: VNWBUFWVNCUUKY-UHFFFAOYSA-N Synonym: 4-chloro-5-2-thienyl thieno 2,3-d pyrimidine,4-chloro-5-thiophen-2-yl thieno 2,3-d pyrimidine,thieno 2,3-d pyrimidine,4-chloro-5-2-thienyl,4-chloro-5-2-thienyl thiopheno 2,3-d pyrimidine,4-chloro-5-thiophen-2-ylthieno 2,3-d pyrimidine PubChem CID: 735732 SMILES: ClC1=C2C(SC=C2C2=CC=CS2)=NC=N1
| PubChem CID | 735732 |
|---|---|
| CAS | 189681-04-7 |
| Molecular Weight (g/mol) | 252.73 |
| MDL Number | MFCD00174019 |
| SMILES | ClC1=C2C(SC=C2C2=CC=CS2)=NC=N1 |
| Synonym | 4-chloro-5-2-thienyl thieno 2,3-d pyrimidine,4-chloro-5-thiophen-2-yl thieno 2,3-d pyrimidine,thieno 2,3-d pyrimidine,4-chloro-5-2-thienyl,4-chloro-5-2-thienyl thiopheno 2,3-d pyrimidine,4-chloro-5-thiophen-2-ylthieno 2,3-d pyrimidine |
| InChI Key | VNWBUFWVNCUUKY-UHFFFAOYSA-N |
| Molecular Formula | C10H5ClN2S2 |
Ethyl isoquinoline-3-carboxylate, 97%, Thermo Scientific™
CAS: 50458-79-2 Molecular Formula: C12H11NO2 Molecular Weight (g/mol): 201.225 MDL Number: MFCD10566077 InChI Key: IFSCYCNNAIADLI-UHFFFAOYSA-N Synonym: ethyl 3-isoquinolinecarboxylate,ethylisoquinoline-3-carboxylate,ethyl isoquinolin-3-carboxylate,3-isoquinolinecarboxylic acid, ethyl ester,isoquinoline-3-carboxylic acid ethyl ester,3-carbethoxyisoquinoline,ksc493m9t,3-ethoxycarbonyl isoquinoline,3-isoquinolinecarboxylic acid ethyl ester PubChem CID: 11435602 IUPAC Name: ethyl isoquinoline-3-carboxylate SMILES: CCOC(=O)C1=CC2=CC=CC=C2C=N1
| PubChem CID | 11435602 |
|---|---|
| CAS | 50458-79-2 |
| Molecular Weight (g/mol) | 201.225 |
| MDL Number | MFCD10566077 |
| SMILES | CCOC(=O)C1=CC2=CC=CC=C2C=N1 |
| Synonym | ethyl 3-isoquinolinecarboxylate,ethylisoquinoline-3-carboxylate,ethyl isoquinolin-3-carboxylate,3-isoquinolinecarboxylic acid, ethyl ester,isoquinoline-3-carboxylic acid ethyl ester,3-carbethoxyisoquinoline,ksc493m9t,3-ethoxycarbonyl isoquinoline,3-isoquinolinecarboxylic acid ethyl ester |
| IUPAC Name | ethyl isoquinoline-3-carboxylate |
| InChI Key | IFSCYCNNAIADLI-UHFFFAOYSA-N |
| Molecular Formula | C12H11NO2 |
2-Bromo-1-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-ethanone, 97%, Thermo Scientific™
CAS: 19815-97-5 Molecular Formula: C10H9BrO3 Molecular Weight (g/mol): 257.08 MDL Number: MFCD04972617 InChI Key: BSROYFIAEPSLCT-UHFFFAOYSA-N Synonym: 2-bromo-1-2,3-dihydrobenzo b 1,4 dioxin-5-yl ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl-1-ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,5-bromoacetyl-1,4-benzodioxane,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethan-1-one,5-bromoacetyl-2,3-dihydro-1,4-benzodioxine,2-bromanyl-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,1-2h,3h-benzo 2,3-e 1,4-dioxin-5-yl-2-bromoethan-1-one,ethanone, 2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl PubChem CID: 2795035 IUPAC Name: 2-bromo-1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethanone SMILES: BrCC(=O)C1=C2OCCOC2=CC=C1
| PubChem CID | 2795035 |
|---|---|
| CAS | 19815-97-5 |
| Molecular Weight (g/mol) | 257.08 |
| MDL Number | MFCD04972617 |
| SMILES | BrCC(=O)C1=C2OCCOC2=CC=C1 |
| Synonym | 2-bromo-1-2,3-dihydrobenzo b 1,4 dioxin-5-yl ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl-1-ethanone,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,5-bromoacetyl-1,4-benzodioxane,2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl ethan-1-one,5-bromoacetyl-2,3-dihydro-1,4-benzodioxine,2-bromanyl-1-2,3-dihydro-1,4-benzodioxin-5-yl ethanone,1-2h,3h-benzo 2,3-e 1,4-dioxin-5-yl-2-bromoethan-1-one,ethanone, 2-bromo-1-2,3-dihydro-1,4-benzodioxin-5-yl |
| IUPAC Name | 2-bromo-1-(2,3-dihydro-1,4-benzodioxin-5-yl)ethanone |
| InChI Key | BSROYFIAEPSLCT-UHFFFAOYSA-N |
| Molecular Formula | C10H9BrO3 |
8-(chloromethyl)-6-fluoro-4H-1,3-benzodioxine, 97%, Thermo Scientific™
CAS: 131728-94-4 Molecular Formula: C9H8ClFO2 Molecular Weight (g/mol): 202.61 MDL Number: MFCD00052603 InChI Key: FMONGDHUPLQOCP-UHFFFAOYSA-N Synonym: 8-chloromethyl-6-fluoro-4h-1,3-benzodioxine,8-chloromethyl-6-fluoro-4h-benzo d 1,3 dioxine,4h-1,3-benzodioxin,8-chloromethyl-6-fluoro,8-chloromethyl-6-fluoro-2,4-dihydro-1,3-benzodioxine,8-chloromethyl-6-fluorobenzo-1,3-dioxane,acmc-1c5x1,8-chloromethyl-6-fluoro-4h-benzo 1,3 dioxine,8-chloromethyl-6-fluoro-2h,4h-1,3-benzodioxine,8-chloromethyl-6-fluoro-2h,4h-benzo e 1,3-dioxin PubChem CID: 2780137 IUPAC Name: 8-(chloromethyl)-6-fluoro-4H-1,3-benzodioxine SMILES: FC1=CC(CCl)=C2OCOCC2=C1
| PubChem CID | 2780137 |
|---|---|
| CAS | 131728-94-4 |
| Molecular Weight (g/mol) | 202.61 |
| MDL Number | MFCD00052603 |
| SMILES | FC1=CC(CCl)=C2OCOCC2=C1 |
| Synonym | 8-chloromethyl-6-fluoro-4h-1,3-benzodioxine,8-chloromethyl-6-fluoro-4h-benzo d 1,3 dioxine,4h-1,3-benzodioxin,8-chloromethyl-6-fluoro,8-chloromethyl-6-fluoro-2,4-dihydro-1,3-benzodioxine,8-chloromethyl-6-fluorobenzo-1,3-dioxane,acmc-1c5x1,8-chloromethyl-6-fluoro-4h-benzo 1,3 dioxine,8-chloromethyl-6-fluoro-2h,4h-1,3-benzodioxine,8-chloromethyl-6-fluoro-2h,4h-benzo e 1,3-dioxin |
| IUPAC Name | 8-(chloromethyl)-6-fluoro-4H-1,3-benzodioxine |
| InChI Key | FMONGDHUPLQOCP-UHFFFAOYSA-N |
| Molecular Formula | C9H8ClFO2 |
2-Butyl-1H-imidazole-4-carbaldehyde, 97%, Thermo Scientific™
CAS: 68282-49-5 Molecular Formula: C8H12N2O Molecular Weight (g/mol): 152.197 MDL Number: MFCD01075030 InChI Key: PTHGVOCFAZSNNA-UHFFFAOYSA-N Synonym: 2-butyl-1h-imidazole-4-carbaldehyde,2-butyl-5-formylimidazole,2-butyl-4-formylimidazole,2-butyl-4-imidazolyl formaldehyde,unii-u12g73sqsx,2-butyl-1h-imidazole-5-carboxaldehyde,u12g73sqsx,1h-imidazole-5-carboxaldehyde, 2-butyl,2-butylimidazole-4-carbaldehyde,2-butyl-3h-imidazole-4-carbaldehyde PubChem CID: 2735671 IUPAC Name: 2-butyl-1H-imidazole-5-carbaldehyde SMILES: CCCCC1=NC=C(N1)C=O
| PubChem CID | 2735671 |
|---|---|
| CAS | 68282-49-5 |
| Molecular Weight (g/mol) | 152.197 |
| MDL Number | MFCD01075030 |
| SMILES | CCCCC1=NC=C(N1)C=O |
| Synonym | 2-butyl-1h-imidazole-4-carbaldehyde,2-butyl-5-formylimidazole,2-butyl-4-formylimidazole,2-butyl-4-imidazolyl formaldehyde,unii-u12g73sqsx,2-butyl-1h-imidazole-5-carboxaldehyde,u12g73sqsx,1h-imidazole-5-carboxaldehyde, 2-butyl,2-butylimidazole-4-carbaldehyde,2-butyl-3h-imidazole-4-carbaldehyde |
| IUPAC Name | 2-butyl-1H-imidazole-5-carbaldehyde |
| InChI Key | PTHGVOCFAZSNNA-UHFFFAOYSA-N |
| Molecular Formula | C8H12N2O |
(4-Piperidinophenyl)methylamine, 97%, Thermo Scientific™
CAS: 214759-73-6 Molecular Formula: C12H18N2 Molecular Weight (g/mol): 190.29 MDL Number: MFCD06659080 InChI Key: WROBJEHXMLQDQP-UHFFFAOYSA-N Synonym: 4-piperidinophenyl methylamine,4-piperidin-1-yl phenyl methanamine,4-piperidinobenzylamine,4-piperidin-1-yl-benzylamine,1-4-piperidin-1-yl phenyl methanamine,4-piperidin-1yl benzylamine,4-piperidin-1ylphenyl methylamine,4-piperidylphenyl methylamine,4-1-piperidyl phenyl methanamine PubChem CID: 2795551 IUPAC Name: (4-piperidin-1-ylphenyl)methanamine SMILES: NCC1=CC=C(C=C1)N1CCCCC1
| PubChem CID | 2795551 |
|---|---|
| CAS | 214759-73-6 |
| Molecular Weight (g/mol) | 190.29 |
| MDL Number | MFCD06659080 |
| SMILES | NCC1=CC=C(C=C1)N1CCCCC1 |
| Synonym | 4-piperidinophenyl methylamine,4-piperidin-1-yl phenyl methanamine,4-piperidinobenzylamine,4-piperidin-1-yl-benzylamine,1-4-piperidin-1-yl phenyl methanamine,4-piperidin-1yl benzylamine,4-piperidin-1ylphenyl methylamine,4-piperidylphenyl methylamine,4-1-piperidyl phenyl methanamine |
| IUPAC Name | (4-piperidin-1-ylphenyl)methanamine |
| InChI Key | WROBJEHXMLQDQP-UHFFFAOYSA-N |
| Molecular Formula | C12H18N2 |
6-methoxypyrid-2-ylamine, 97%, Thermo Scientific™
CAS: 17920-35-3 Molecular Formula: C6H8N2O Molecular Weight (g/mol): 124.143 MDL Number: MFCD04972542 InChI Key: DEUALFRBMNMGDS-UHFFFAOYSA-N Synonym: 2-amino-6-methoxypyridine,6-methoxy-pyridin-2-ylamine,6-methoxy-2-pyridinamine,6-methoxypyrid-2-ylamine,6-methoxy-2-pyridylamine,2-amino-6-methoxy pyridine,2-pyridinamine, 6-methoxy,methoxypyridin-6-amine,acmc-209efc,6-methoxy-2-aminopyridin PubChem CID: 580053 IUPAC Name: 6-methoxypyridin-2-amine SMILES: COC1=CC=CC(=N1)N
| PubChem CID | 580053 |
|---|---|
| CAS | 17920-35-3 |
| Molecular Weight (g/mol) | 124.143 |
| MDL Number | MFCD04972542 |
| SMILES | COC1=CC=CC(=N1)N |
| Synonym | 2-amino-6-methoxypyridine,6-methoxy-pyridin-2-ylamine,6-methoxy-2-pyridinamine,6-methoxypyrid-2-ylamine,6-methoxy-2-pyridylamine,2-amino-6-methoxy pyridine,2-pyridinamine, 6-methoxy,methoxypyridin-6-amine,acmc-209efc,6-methoxy-2-aminopyridin |
| IUPAC Name | 6-methoxypyridin-2-amine |
| InChI Key | DEUALFRBMNMGDS-UHFFFAOYSA-N |
| Molecular Formula | C6H8N2O |
1-Benzothiophene-2-carbaldehyde, 97%, Thermo Scientific™
CAS: 3541-37-5 Molecular Formula: C9H6OS Molecular Weight (g/mol): 162.21 MDL Number: MFCD01075041 InChI Key: NXSVNPSWARVMAY-UHFFFAOYSA-N Synonym: benzo b thiophene-2-carboxaldehyde,benzo b thiophene-2-carbaldehyde,thianaphthene-2-carboxaldehyde,benzothiophene-2-carboxaldehyde,acmc-209igo,2-formylbenzo b thiophene,2-benzothiophenecarbaldehyde,2-formyl-benzo b thiophene,benzothiophene-2-carbaldehyde,2-benzothiophenecarboxaldehyde PubChem CID: 736500 IUPAC Name: 1-benzothiophene-2-carbaldehyde SMILES: O=CC1=CC2=CC=CC=C2S1
| PubChem CID | 736500 |
|---|---|
| CAS | 3541-37-5 |
| Molecular Weight (g/mol) | 162.21 |
| MDL Number | MFCD01075041 |
| SMILES | O=CC1=CC2=CC=CC=C2S1 |
| Synonym | benzo b thiophene-2-carboxaldehyde,benzo b thiophene-2-carbaldehyde,thianaphthene-2-carboxaldehyde,benzothiophene-2-carboxaldehyde,acmc-209igo,2-formylbenzo b thiophene,2-benzothiophenecarbaldehyde,2-formyl-benzo b thiophene,benzothiophene-2-carbaldehyde,2-benzothiophenecarboxaldehyde |
| IUPAC Name | 1-benzothiophene-2-carbaldehyde |
| InChI Key | NXSVNPSWARVMAY-UHFFFAOYSA-N |
| Molecular Formula | C9H6OS |
6-Oxo-1,4,5,6-tetrahydropyridazine-3-carboxylic acid, 97%, Thermo Scientific™
CAS: 27372-38-9 Molecular Formula: C5H6N2O3 Molecular Weight (g/mol): 142.114 MDL Number: MFCD00052030 InChI Key: VUADWGRLHPTYPI-UHFFFAOYSA-N Synonym: 6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxylic acid,1,4,5,6-tetrahydro-6-oxopyridazine-3-carboxylic acid,unii-ot09ztp07e,ot09ztp07e,6-oxo-1,4,5,6-tetrahydro-pyridazine-3-carboxylic acid,3-pyridazinecarboxylic acid, 1,4,5,6-tetrahydro-6-oxo,1,4,5,6-tetrahydro-6-oxo-3-pyridazinecarboxylic acid,6-oxo-1,4,5,6-tetrahydropyridazin-3-carboxylic acid,6-oxo-1,4,5-trihydropyridazine-3-carboxylic acid,pubchem19274 PubChem CID: 99621 IUPAC Name: 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylic acid SMILES: C1CC(=O)NN=C1C(=O)O
| PubChem CID | 99621 |
|---|---|
| CAS | 27372-38-9 |
| Molecular Weight (g/mol) | 142.114 |
| MDL Number | MFCD00052030 |
| SMILES | C1CC(=O)NN=C1C(=O)O |
| Synonym | 6-oxo-1,4,5,6-tetrahydropyridazine-3-carboxylic acid,1,4,5,6-tetrahydro-6-oxopyridazine-3-carboxylic acid,unii-ot09ztp07e,ot09ztp07e,6-oxo-1,4,5,6-tetrahydro-pyridazine-3-carboxylic acid,3-pyridazinecarboxylic acid, 1,4,5,6-tetrahydro-6-oxo,1,4,5,6-tetrahydro-6-oxo-3-pyridazinecarboxylic acid,6-oxo-1,4,5,6-tetrahydropyridazin-3-carboxylic acid,6-oxo-1,4,5-trihydropyridazine-3-carboxylic acid,pubchem19274 |
| IUPAC Name | 6-oxo-4,5-dihydro-1H-pyridazine-3-carboxylic acid |
| InChI Key | VUADWGRLHPTYPI-UHFFFAOYSA-N |
| Molecular Formula | C5H6N2O3 |
4,6-Dimethyl-1,3,5-triazin-2-amine hydrate, ≥95%, Thermo Scientific™
CAS: 175278-59-8 Molecular Formula: C5H10N4O Molecular Weight (g/mol): 142.16 MDL Number: MFCD00663061 InChI Key: CZKUOCRCKNMNTI-UHFFFAOYSA-N Synonym: 4,6-dimethyl-1,3,5-triazin-2-amine hydrate,dimethyl-1,3,5-triazin-2-amine hydrate,1,3,5-triazin-2-amine,4,6-dimethyl-, hydrate 1:1,2-amino-4,6-dimethyl-1,3,5-triazine hydrate,4,6-dimethyl-1,3,5-triazine-2-ylamine, oxamethane,1,3,5-triazin-2-amine,4,6-dimethyl-,hydrate 1:1 PubChem CID: 2782054 IUPAC Name: 4,6-dimethyl-1,3,5-triazin-2-amine;hydrate SMILES: O.CC1=NC(N)=NC(C)=N1
| PubChem CID | 2782054 |
|---|---|
| CAS | 175278-59-8 |
| Molecular Weight (g/mol) | 142.16 |
| MDL Number | MFCD00663061 |
| SMILES | O.CC1=NC(N)=NC(C)=N1 |
| Synonym | 4,6-dimethyl-1,3,5-triazin-2-amine hydrate,dimethyl-1,3,5-triazin-2-amine hydrate,1,3,5-triazin-2-amine,4,6-dimethyl-, hydrate 1:1,2-amino-4,6-dimethyl-1,3,5-triazine hydrate,4,6-dimethyl-1,3,5-triazine-2-ylamine, oxamethane,1,3,5-triazin-2-amine,4,6-dimethyl-,hydrate 1:1 |
| IUPAC Name | 4,6-dimethyl-1,3,5-triazin-2-amine;hydrate |
| InChI Key | CZKUOCRCKNMNTI-UHFFFAOYSA-N |
| Molecular Formula | C5H10N4O |
3-(2-Furyl)benzoic acid, 97%, Thermo Scientific™
CAS: 35461-99-5 Molecular Formula: C11H8O3 Molecular Weight (g/mol): 188.182 MDL Number: MFCD02690979 InChI Key: RQVVFGRDMHDHNI-UHFFFAOYSA-N Synonym: 3-furan-2-yl benzoic acid,3-2-furyl benzoic acid,3-fur-2-ylbenzoic acid,3-furan-2-yl-benzoic acid,m-2-furyl benzoic acid,benzoic acid, 3-2-furanyl PubChem CID: 5037933 IUPAC Name: 3-(furan-2-yl)benzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C2=CC=CO2
| PubChem CID | 5037933 |
|---|---|
| CAS | 35461-99-5 |
| Molecular Weight (g/mol) | 188.182 |
| MDL Number | MFCD02690979 |
| SMILES | C1=CC(=CC(=C1)C(=O)O)C2=CC=CO2 |
| Synonym | 3-furan-2-yl benzoic acid,3-2-furyl benzoic acid,3-fur-2-ylbenzoic acid,3-furan-2-yl-benzoic acid,m-2-furyl benzoic acid,benzoic acid, 3-2-furanyl |
| IUPAC Name | 3-(furan-2-yl)benzoic acid |
| InChI Key | RQVVFGRDMHDHNI-UHFFFAOYSA-N |
| Molecular Formula | C11H8O3 |
Methyl 5-bromo-2-(methylsulfanyl)-4-pyrimidinecarboxylate, 97%, Thermo Scientific™
CAS: 50593-91-4 Molecular Formula: C7H7BrN2O2S Molecular Weight (g/mol): 263.11 MDL Number: MFCD05664428 InChI Key: MYZJIEWTRJTWCD-UHFFFAOYSA-N Synonym: methyl 5-bromo-2-methylsulfanyl-4-pyrimidinecarboxylate,methyl 5-bromo-2-methylthio pyrimidine-4-carboxylate,methyl 5-bromo-2-methylsulfanyl pyrimidine-4-carboxylate,methyl 5-bromo-2-methylthio-4-pyrimidinecarboxylate,methylbromomethylsulfanylpyrimidinecarboxylate,methyl 5-bromo-2-methylthiopyrimidine-4-carboxylate,methyl-5-bromo-2-methylthio pyrimidine-4-carboxylate,methyl 5-bromo-2-methylsulfanyl-4-pyrimidinecarb,methyl 5-bromo-2-methylsulfanyl-4-pyrimidinecarboxylate,97,5-bromo-2-methylsulfanylpyrimidine-4-carboxylic acid methyl ester PubChem CID: 2794729 SMILES: COC(=O)C1=NC(SC)=NC=C1Br
| PubChem CID | 2794729 |
|---|---|
| CAS | 50593-91-4 |
| Molecular Weight (g/mol) | 263.11 |
| MDL Number | MFCD05664428 |
| SMILES | COC(=O)C1=NC(SC)=NC=C1Br |
| Synonym | methyl 5-bromo-2-methylsulfanyl-4-pyrimidinecarboxylate,methyl 5-bromo-2-methylthio pyrimidine-4-carboxylate,methyl 5-bromo-2-methylsulfanyl pyrimidine-4-carboxylate,methyl 5-bromo-2-methylthio-4-pyrimidinecarboxylate,methylbromomethylsulfanylpyrimidinecarboxylate,methyl 5-bromo-2-methylthiopyrimidine-4-carboxylate,methyl-5-bromo-2-methylthio pyrimidine-4-carboxylate,methyl 5-bromo-2-methylsulfanyl-4-pyrimidinecarb,methyl 5-bromo-2-methylsulfanyl-4-pyrimidinecarboxylate,97,5-bromo-2-methylsulfanylpyrimidine-4-carboxylic acid methyl ester |
| InChI Key | MYZJIEWTRJTWCD-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrN2O2S |