Heteroaromatic compounds
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4,5-Dicyanoimidazole, 99%
CAS: 1122-28-7 Molecular Formula: C5H2N4 Molecular Weight (g/mol): 118.10 MDL Number: MFCD00005194 InChI Key: XGDRLCRGKUCBQL-UHFFFAOYSA-N PubChem CID: 70729 IUPAC Name: 1H-imidazole-4,5-dicarbonitrile SMILES: N#CC1=C(N=CN1)C#N
| PubChem CID | 70729 |
|---|---|
| CAS | 1122-28-7 |
| Molecular Weight (g/mol) | 118.10 |
| MDL Number | MFCD00005194 |
| SMILES | N#CC1=C(N=CN1)C#N |
| IUPAC Name | 1H-imidazole-4,5-dicarbonitrile |
| InChI Key | XGDRLCRGKUCBQL-UHFFFAOYSA-N |
| Molecular Formula | C5H2N4 |
Phenazine, 98%
CAS: 92-82-0 Molecular Formula: C12H8N2 Molecular Weight (g/mol): 180.21 MDL Number: MFCD00005023 InChI Key: PCNDJXKNXGMECE-UHFFFAOYSA-N Synonym: dibenzopyrazine,azophenylene,dibenzoparadiazine,acridizine,9,10-diazaanthracene,dibenzo-p-diazine,unii-2jhr6k463w,phenazine,dibenzo b,e pyrazine,acmc-209rhs PubChem CID: 4757 ChEBI: CHEBI:36674 IUPAC Name: phenazine SMILES: C1=CC=C2C(=C1)N=C3C=CC=CC3=N2
| PubChem CID | 4757 |
|---|---|
| CAS | 92-82-0 |
| Molecular Weight (g/mol) | 180.21 |
| ChEBI | CHEBI:36674 |
| MDL Number | MFCD00005023 |
| SMILES | C1=CC=C2C(=C1)N=C3C=CC=CC3=N2 |
| Synonym | dibenzopyrazine,azophenylene,dibenzoparadiazine,acridizine,9,10-diazaanthracene,dibenzo-p-diazine,unii-2jhr6k463w,phenazine,dibenzo b,e pyrazine,acmc-209rhs |
| IUPAC Name | phenazine |
| InChI Key | PCNDJXKNXGMECE-UHFFFAOYSA-N |
| Molecular Formula | C12H8N2 |
Purine, 99%
CAS: 120-73-0 MDL Number: MFCD00079221 InChI Key: KDCGOANMDULRCW-UHFFFAOYSA-N Synonym: purine,9h-purine,1h-purine,isopurine,beta-purine,7h-imidazo 4,5-d pyrimidine,imidazo 4,5-d pyrimidine,3,5,7-triazaindole,9h-purine van,3h-purine PubChem CID: 1044 ChEBI: CHEBI:17258 IUPAC Name: 7H-purine SMILES: C1=C2C(=NC=N1)N=CN2
| PubChem CID | 1044 |
|---|---|
| CAS | 120-73-0 |
| ChEBI | CHEBI:17258 |
| MDL Number | MFCD00079221 |
| SMILES | C1=C2C(=NC=N1)N=CN2 |
| Synonym | purine,9h-purine,1h-purine,isopurine,beta-purine,7h-imidazo 4,5-d pyrimidine,imidazo 4,5-d pyrimidine,3,5,7-triazaindole,9h-purine van,3h-purine |
| IUPAC Name | 7H-purine |
| InChI Key | KDCGOANMDULRCW-UHFFFAOYSA-N |
3,5-Diphenylpyrazole, 99%
CAS: 1145-01-3 Molecular Formula: C15H12N2 Molecular Weight (g/mol): 220.28 MDL Number: MFCD00039675 InChI Key: JXHKUYQCEJILEI-UHFFFAOYSA-N Synonym: 3,5-diphenylpyrazole,1h-pyrazole, 3,5-diphenyl,pyrazole, 3,5-diphenyl,pyrazole,5-diphenyl,acmc-1bufo,1h-pyrazole,5-diphenyl,cbmicro_048085,3,5-diphenyl pyrazole,3,5-diphenyl-1h-pyrazole 5g PubChem CID: 70840 IUPAC Name: 3,5-diphenyl-1H-pyrazole SMILES: N1N=C(C=C1C1=CC=CC=C1)C1=CC=CC=C1
| PubChem CID | 70840 |
|---|---|
| CAS | 1145-01-3 |
| Molecular Weight (g/mol) | 220.28 |
| MDL Number | MFCD00039675 |
| SMILES | N1N=C(C=C1C1=CC=CC=C1)C1=CC=CC=C1 |
| Synonym | 3,5-diphenylpyrazole,1h-pyrazole, 3,5-diphenyl,pyrazole, 3,5-diphenyl,pyrazole,5-diphenyl,acmc-1bufo,1h-pyrazole,5-diphenyl,cbmicro_048085,3,5-diphenyl pyrazole,3,5-diphenyl-1h-pyrazole 5g |
| IUPAC Name | 3,5-diphenyl-1H-pyrazole |
| InChI Key | JXHKUYQCEJILEI-UHFFFAOYSA-N |
| Molecular Formula | C15H12N2 |
Pyrazinamide, 99%
CAS: 98-96-4 Molecular Formula: C5H5N3O Molecular Weight (g/mol): 123.11 MDL Number: MFCD00006132 InChI Key: IPEHBUMCGVEMRF-UHFFFAOYSA-N Synonym: pyrazinamide,pyrazinecarboxamide,zinamide,pyrazinoic acid amide,2-pyrazinecarboxamide,aldinamide,aldinamid,pirazinamid,pyrazineamide,pyrafat PubChem CID: 1046 ChEBI: CHEBI:45285 IUPAC Name: pyrazine-2-carboxamide SMILES: C1=CN=C(C=N1)C(=O)N
| PubChem CID | 1046 |
|---|---|
| CAS | 98-96-4 |
| Molecular Weight (g/mol) | 123.11 |
| ChEBI | CHEBI:45285 |
| MDL Number | MFCD00006132 |
| SMILES | C1=CN=C(C=N1)C(=O)N |
| Synonym | pyrazinamide,pyrazinecarboxamide,zinamide,pyrazinoic acid amide,2-pyrazinecarboxamide,aldinamide,aldinamid,pirazinamid,pyrazineamide,pyrafat |
| IUPAC Name | pyrazine-2-carboxamide |
| InChI Key | IPEHBUMCGVEMRF-UHFFFAOYSA-N |
| Molecular Formula | C5H5N3O |
2-Hydroxyquinoxaline, 98%, Thermo Scientific™
CAS: 1196-57-2 Molecular Formula: C8H6N2O Molecular Weight (g/mol): 146.15 MDL Number: MFCD00006722 InChI Key: FFRYUAVNPBUEIC-UHFFFAOYSA-N Synonym: 2-hydroxyquinoxaline,quinoxalin-2-ol,2-quinoxalinol,2 1h-quinoxalinone,quinoxalin-2 1h-one,quinoxalin-2-one,2-quinoxalinone,3-quinoxalinone,2-quinoxalone,1,2-dihydroquinoxalin-2-one PubChem CID: 14526 ChEBI: CHEBI:38890 IUPAC Name: 1H-quinoxalin-2-one SMILES: O=C1NC2=CC=CC=C2N=C1
| PubChem CID | 14526 |
|---|---|
| CAS | 1196-57-2 |
| Molecular Weight (g/mol) | 146.15 |
| ChEBI | CHEBI:38890 |
| MDL Number | MFCD00006722 |
| SMILES | O=C1NC2=CC=CC=C2N=C1 |
| Synonym | 2-hydroxyquinoxaline,quinoxalin-2-ol,2-quinoxalinol,2 1h-quinoxalinone,quinoxalin-2 1h-one,quinoxalin-2-one,2-quinoxalinone,3-quinoxalinone,2-quinoxalone,1,2-dihydroquinoxalin-2-one |
| IUPAC Name | 1H-quinoxalin-2-one |
| InChI Key | FFRYUAVNPBUEIC-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O |
4-Cyanoimidazole, 95%
CAS: 57090-88-7 Molecular Formula: C4H3N3 Molecular Weight (g/mol): 93.09 MDL Number: MFCD00233358 InChI Key: NWVGXXPWOYZODV-UHFFFAOYSA-N Synonym: 1h-imidazole-4-carbonitrile,4-cyanoimidazole,4-cyano-1h-imidazole,3h-imidazole-4-carbonitrile,imidazole-4-carbonitrile,pubchem18770,acmc-209lvz,5-imidazole carbonitrile,1h-imidazol-4-kohlenitrile,ksc269a8n PubChem CID: 564457 IUPAC Name: 1H-imidazole-5-carbonitrile SMILES: N#CC1=CN=CN1
| PubChem CID | 564457 |
|---|---|
| CAS | 57090-88-7 |
| Molecular Weight (g/mol) | 93.09 |
| MDL Number | MFCD00233358 |
| SMILES | N#CC1=CN=CN1 |
| Synonym | 1h-imidazole-4-carbonitrile,4-cyanoimidazole,4-cyano-1h-imidazole,3h-imidazole-4-carbonitrile,imidazole-4-carbonitrile,pubchem18770,acmc-209lvz,5-imidazole carbonitrile,1h-imidazol-4-kohlenitrile,ksc269a8n |
| IUPAC Name | 1H-imidazole-5-carbonitrile |
| InChI Key | NWVGXXPWOYZODV-UHFFFAOYSA-N |
| Molecular Formula | C4H3N3 |
2-Hydrazinopyrimidine, 97%
CAS: 7504-94-1 Molecular Formula: C4H6N4 Molecular Weight (g/mol): 110.12 MDL Number: MFCD01249337 InChI Key: QDGHXQFTWKRQTG-UHFFFAOYSA-N Synonym: 2-hydrazinylpyrimidine,2-hydrazinopyrimidine,2-hydrazino-pyrimidine,pyrimidin-2-yl-hydrazine,pyrimidine-2-ylhydrazine,2 1h-pyrimidinone, hydrazone,2 1h-pyrimidinone, hydrazone 9ci,hydrazinopyrimidine,aminoiminopyrimidine,2-hydrazinopyrimdine PubChem CID: 346558 IUPAC Name: pyrimidin-2-ylhydrazine SMILES: NNC1=NC=CC=N1
| PubChem CID | 346558 |
|---|---|
| CAS | 7504-94-1 |
| Molecular Weight (g/mol) | 110.12 |
| MDL Number | MFCD01249337 |
| SMILES | NNC1=NC=CC=N1 |
| Synonym | 2-hydrazinylpyrimidine,2-hydrazinopyrimidine,2-hydrazino-pyrimidine,pyrimidin-2-yl-hydrazine,pyrimidine-2-ylhydrazine,2 1h-pyrimidinone, hydrazone,2 1h-pyrimidinone, hydrazone 9ci,hydrazinopyrimidine,aminoiminopyrimidine,2-hydrazinopyrimdine |
| IUPAC Name | pyrimidin-2-ylhydrazine |
| InChI Key | QDGHXQFTWKRQTG-UHFFFAOYSA-N |
| Molecular Formula | C4H6N4 |
5-Aminobenzothiazole, 95%
CAS: 1123-93-9 Molecular Formula: C7H6N2S Molecular Weight (g/mol): 150.20 MDL Number: MFCD04115282 InChI Key: UJZYHMZRXGNDFB-UHFFFAOYSA-N Synonym: 5-benzothiazolamine,benzothiazol-5-ylamine,benzo d thiazol-5-amine,benzothiazol-5-amine,5-amino-1,3-benzothiazole,5-aminobenzothiazole,1,3-benzothiazole-5-amine,1,3-benzothiazol-5-ylamine,5-amino-1,3-benzothiazol,5-amino-benzothiazole PubChem CID: 70749 IUPAC Name: 1,3-benzothiazol-5-amine SMILES: NC1=CC=C2SC=NC2=C1
| PubChem CID | 70749 |
|---|---|
| CAS | 1123-93-9 |
| Molecular Weight (g/mol) | 150.20 |
| MDL Number | MFCD04115282 |
| SMILES | NC1=CC=C2SC=NC2=C1 |
| Synonym | 5-benzothiazolamine,benzothiazol-5-ylamine,benzo d thiazol-5-amine,benzothiazol-5-amine,5-amino-1,3-benzothiazole,5-aminobenzothiazole,1,3-benzothiazole-5-amine,1,3-benzothiazol-5-ylamine,5-amino-1,3-benzothiazol,5-amino-benzothiazole |
| IUPAC Name | 1,3-benzothiazol-5-amine |
| InChI Key | UJZYHMZRXGNDFB-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2S |
5-Amino-1,3,4-thiadiazole-2-thiol, 98%
CAS: 2349-67-9 Molecular Formula: C2H3N3S2 Molecular Weight (g/mol): 133.2 MDL Number: MFCD00003108 InChI Key: GDGIVSREGUOIJZ-UHFFFAOYSA-N Synonym: 5-amino-1,3,4-thiadiazole-2-thiol,2-amino-5-mercapto-1,3,4-thiadiazole,usaf pd-25,1,3,4-thiadiazole-2 3h-thione, 5-amino,unii-b1heg7v21s,5-amino-1,3,4-thiadiazole-2 3h-thione,2-amino-1,3,4-thiadiazole-5-thiol,2-thiol-5-amino-1,3,4-thiadiazole,ccris 6893,2-mercapto-5-amino-1,3,4-thiadiazole PubChem CID: 2723847 IUPAC Name: 5-amino-3H-1,3,4-thiadiazole-2-thione SMILES: C1(=NNC(=S)S1)N
| PubChem CID | 2723847 |
|---|---|
| CAS | 2349-67-9 |
| Molecular Weight (g/mol) | 133.2 |
| MDL Number | MFCD00003108 |
| SMILES | C1(=NNC(=S)S1)N |
| Synonym | 5-amino-1,3,4-thiadiazole-2-thiol,2-amino-5-mercapto-1,3,4-thiadiazole,usaf pd-25,1,3,4-thiadiazole-2 3h-thione, 5-amino,unii-b1heg7v21s,5-amino-1,3,4-thiadiazole-2 3h-thione,2-amino-1,3,4-thiadiazole-5-thiol,2-thiol-5-amino-1,3,4-thiadiazole,ccris 6893,2-mercapto-5-amino-1,3,4-thiadiazole |
| IUPAC Name | 5-amino-3H-1,3,4-thiadiazole-2-thione |
| InChI Key | GDGIVSREGUOIJZ-UHFFFAOYSA-N |
| Molecular Formula | C2H3N3S2 |
3-(2-Thienyl)propanoic acid, 98%
CAS: 5928-51-8 Molecular Formula: C7H8O2S Molecular Weight (g/mol): 156.2 MDL Number: MFCD00047093 InChI Key: MJPVYTKZYZPIQA-UHFFFAOYSA-N Synonym: 3-2-thienyl propanoic acid,3-2-thienyl propionic acid,2-thiophenepropanoic acid,3-thiophen-2-yl propanoic acid,2-thiophenepropionic acid,maybridge3_005592,3-2-thienyl propionic pound inverted question markacid,3-thiophen-2-yl-propionic acid,thiolpropionic acid,pubchem23928 PubChem CID: 703169 IUPAC Name: 3-thiophen-2-ylpropanoic acid SMILES: C1=CSC(=C1)CCC(=O)O
| PubChem CID | 703169 |
|---|---|
| CAS | 5928-51-8 |
| Molecular Weight (g/mol) | 156.2 |
| MDL Number | MFCD00047093 |
| SMILES | C1=CSC(=C1)CCC(=O)O |
| Synonym | 3-2-thienyl propanoic acid,3-2-thienyl propionic acid,2-thiophenepropanoic acid,3-thiophen-2-yl propanoic acid,2-thiophenepropionic acid,maybridge3_005592,3-2-thienyl propionic pound inverted question markacid,3-thiophen-2-yl-propionic acid,thiolpropionic acid,pubchem23928 |
| IUPAC Name | 3-thiophen-2-ylpropanoic acid |
| InChI Key | MJPVYTKZYZPIQA-UHFFFAOYSA-N |
| Molecular Formula | C7H8O2S |
Isoquinoline-8-carboxylic acid, 97%, Thermo Scientific Chemicals
CAS: 61563-43-7 Molecular Formula: C10H7NO2 Molecular Weight (g/mol): 173.17 MDL Number: MFCD06738935 InChI Key: VMNZQPRIUSJCOH-UHFFFAOYSA-N Synonym: 8-isoquinolinecarboxylic acid,8-carboxyisoquinoline,8-isoquinolinecarboxylicacid,8-carboxy-2-azanaphthalene PubChem CID: 21393830 IUPAC Name: isoquinoline-8-carboxylic acid SMILES: C1=CC2=C(C=NC=C2)C(=C1)C(=O)O
| PubChem CID | 21393830 |
|---|---|
| CAS | 61563-43-7 |
| Molecular Weight (g/mol) | 173.17 |
| MDL Number | MFCD06738935 |
| SMILES | C1=CC2=C(C=NC=C2)C(=C1)C(=O)O |
| Synonym | 8-isoquinolinecarboxylic acid,8-carboxyisoquinoline,8-isoquinolinecarboxylicacid,8-carboxy-2-azanaphthalene |
| IUPAC Name | isoquinoline-8-carboxylic acid |
| InChI Key | VMNZQPRIUSJCOH-UHFFFAOYSA-N |
| Molecular Formula | C10H7NO2 |
5-Aminoindole, 97%
CAS: 5192-03-0 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.17 MDL Number: MFCD00005679 InChI Key: ZCBIFHNDZBSCEP-UHFFFAOYSA-N Synonym: 5-aminoindole,indol-5-ylamine,indole, 5-amino,unii-q732pg0y16,1h-indol-5-ylamine,indole-5-ylamine,5-indolamine,5-amino indole,5-amino-indole PubChem CID: 78867 ChEBI: CHEBI:33067 IUPAC Name: 1H-indol-5-amine SMILES: NC1=CC=C2NC=CC2=C1
| PubChem CID | 78867 |
|---|---|
| CAS | 5192-03-0 |
| Molecular Weight (g/mol) | 132.17 |
| ChEBI | CHEBI:33067 |
| MDL Number | MFCD00005679 |
| SMILES | NC1=CC=C2NC=CC2=C1 |
| Synonym | 5-aminoindole,indol-5-ylamine,indole, 5-amino,unii-q732pg0y16,1h-indol-5-ylamine,indole-5-ylamine,5-indolamine,5-amino indole,5-amino-indole |
| IUPAC Name | 1H-indol-5-amine |
| InChI Key | ZCBIFHNDZBSCEP-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2 |