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Azoles

Organic compounds that consist of five-membered heterocyclic molecules containing a nitrogen atom and at least one other non-carbon atom as part of the ring.
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1

5-(Bromomethyl)-3-phenylisoxazole, 97%, Thermo Scientific™

CAS: 2039-50-1 Molecular Formula: C10H8BrNO Molecular Weight (g/mol): 238.084 MDL Number: MFCD00159724 InChI Key: ANRMBFFXQKJEIS-UHFFFAOYSA-N PubChem CID: 2748796 IUPAC Name: 5-(bromomethyl)-3-phenyl-1,2-oxazole SMILES: C1=CC=C(C=C1)C2=NOC(=C2)CBr

PubChem CID 2748796
CAS 2039-50-1
Molecular Weight (g/mol) 238.084
MDL Number MFCD00159724
SMILES C1=CC=C(C=C1)C2=NOC(=C2)CBr
IUPAC Name 5-(bromomethyl)-3-phenyl-1,2-oxazole
InChI Key ANRMBFFXQKJEIS-UHFFFAOYSA-N
Molecular Formula C10H8BrNO
2

2-Pyrrolidin-1-yl-1,3-thiazole-5-carboxylic acid, 97%, Thermo Scientific™

CAS: 941716-91-2 Molecular Formula: C8H10N2O2S Molecular Weight (g/mol): 198.24 MDL Number: MFCD09879943 InChI Key: KPQGRYOIUITVHX-UHFFFAOYSA-N Synonym: 2-pyrrolidin-1-yl thiazole-5-carboxylic acid,2-pyrrolidin-1-yl-1,3-thiazole-5-carboxylic acid,2-pyrrolidinyl-1,3-thiazole-5-carboxylic acid PubChem CID: 24229715 SMILES: OC(=O)C1=CN=C(S1)N1CCCC1

PubChem CID 24229715
CAS 941716-91-2
Molecular Weight (g/mol) 198.24
MDL Number MFCD09879943
SMILES OC(=O)C1=CN=C(S1)N1CCCC1
Synonym 2-pyrrolidin-1-yl thiazole-5-carboxylic acid,2-pyrrolidin-1-yl-1,3-thiazole-5-carboxylic acid,2-pyrrolidinyl-1,3-thiazole-5-carboxylic acid
InChI Key KPQGRYOIUITVHX-UHFFFAOYSA-N
Molecular Formula C8H10N2O2S
3

3-(Chloromethyl)-5-methylisoxazole, 97%, Thermo Scientific™

CAS: 35166-37-1 Molecular Formula: C5H6ClNO Molecular Weight (g/mol): 131.56 MDL Number: MFCD00221166 InChI Key: FEXTXBAFBURKGS-UHFFFAOYSA-N Synonym: 3-chloromethyl-5-methylisoxazole,3-chloromethyl-5-methyl-1,2-oxazole,3-chloromethyl-5-methyl-isoxazole,pubchem8710,zlchem 1024,acmc-209idp,3-chloromethyl-5-methyisoxazole,3-choromethyl-5-methylisoxazole,5-methyl-3-chloromethylisoxazole PubChem CID: 2735763 IUPAC Name: 3-(chloromethyl)-5-methyl-1,2-oxazole SMILES: CC1=CC(CCl)=NO1

PubChem CID 2735763
CAS 35166-37-1
Molecular Weight (g/mol) 131.56
MDL Number MFCD00221166
SMILES CC1=CC(CCl)=NO1
Synonym 3-chloromethyl-5-methylisoxazole,3-chloromethyl-5-methyl-1,2-oxazole,3-chloromethyl-5-methyl-isoxazole,pubchem8710,zlchem 1024,acmc-209idp,3-chloromethyl-5-methyisoxazole,3-choromethyl-5-methylisoxazole,5-methyl-3-chloromethylisoxazole
IUPAC Name 3-(chloromethyl)-5-methyl-1,2-oxazole
InChI Key FEXTXBAFBURKGS-UHFFFAOYSA-N
Molecular Formula C5H6ClNO
4

Ethyl 5-(chloromethyl)-3-isoxazolecarboxylate, 97%, Thermo Scientific™

CAS: 3209-40-3 Molecular Formula: C7H8ClNO3 Molecular Weight (g/mol): 189.60 MDL Number: MFCD08445409 InChI Key: RNURPQMTRDHCNM-UHFFFAOYSA-N Synonym: ethyl 5-chloromethyl isoxazole-3-carboxylate,ethyl 5-chloromethyl-3-isoxazolecarboxylate,ethyl 5-chloromethyl-1,2-oxazole-3-carboxylate,ethyl 5-chloromethylisoxazole-3-carboxylate,5-chloromethyl-isoxazole-3-carboxylic acid ethyl ester,ehyl 5-chloromethyl-1,2-oxazole-3-carboxylate,3-isoxazolecarboxylicacid, 5-chloromethyl-, ethyl ester PubChem CID: 14674306 IUPAC Name: ethyl 5-(chloromethyl)-1,2-oxazole-3-carboxylate SMILES: CCOC(=O)C1=NOC(CCl)=C1

PubChem CID 14674306
CAS 3209-40-3
Molecular Weight (g/mol) 189.60
MDL Number MFCD08445409
SMILES CCOC(=O)C1=NOC(CCl)=C1
Synonym ethyl 5-chloromethyl isoxazole-3-carboxylate,ethyl 5-chloromethyl-3-isoxazolecarboxylate,ethyl 5-chloromethyl-1,2-oxazole-3-carboxylate,ethyl 5-chloromethylisoxazole-3-carboxylate,5-chloromethyl-isoxazole-3-carboxylic acid ethyl ester,ehyl 5-chloromethyl-1,2-oxazole-3-carboxylate,3-isoxazolecarboxylicacid, 5-chloromethyl-, ethyl ester
IUPAC Name ethyl 5-(chloromethyl)-1,2-oxazole-3-carboxylate
InChI Key RNURPQMTRDHCNM-UHFFFAOYSA-N
Molecular Formula C7H8ClNO3
5

5-Methyl-4-isoxazolesulfonyl chloride, 95%, Thermo Scientific™

CAS: 321309-26-6 Molecular Formula: C4H4ClNO3S Molecular Weight (g/mol): 181.59 MDL Number: MFCD02681975 InChI Key: STYUNYVEEFPQMF-UHFFFAOYSA-N Synonym: 5-methyl-4-isoxazolesulfonyl chloride,5-methylisoxazole-4-sulfonyl chloride,4-isoxazolesulfonyl chloride, 5-methyl,4-chlorosulfonyl-5-methylisoxazole,chloro 5-methylisoxazol-4-yl sulfone,4-chlorosulphonyl-5-methylisoxazole,4-isoxazolesulfonylchloride, 5-methyl,5-methyl-4-isoxazole sulfonyl chloride,5-methyl-isoxazole-4-sulfonyl chloride,5-methylisoxazole-4-sulphonyl chloride PubChem CID: 2776141 IUPAC Name: 5-methyl-1,2-oxazole-4-sulfonyl chloride SMILES: CC1=C(C=NO1)S(=O)(=O)Cl

PubChem CID 2776141
CAS 321309-26-6
Molecular Weight (g/mol) 181.59
MDL Number MFCD02681975
SMILES CC1=C(C=NO1)S(=O)(=O)Cl
Synonym 5-methyl-4-isoxazolesulfonyl chloride,5-methylisoxazole-4-sulfonyl chloride,4-isoxazolesulfonyl chloride, 5-methyl,4-chlorosulfonyl-5-methylisoxazole,chloro 5-methylisoxazol-4-yl sulfone,4-chlorosulphonyl-5-methylisoxazole,4-isoxazolesulfonylchloride, 5-methyl,5-methyl-4-isoxazole sulfonyl chloride,5-methyl-isoxazole-4-sulfonyl chloride,5-methylisoxazole-4-sulphonyl chloride
IUPAC Name 5-methyl-1,2-oxazole-4-sulfonyl chloride
InChI Key STYUNYVEEFPQMF-UHFFFAOYSA-N
Molecular Formula C4H4ClNO3S
6

5-Methyl-3-phenylisoxazole-4-carbonyl chloride, 90%, Thermo Scientific™

CAS: 16883-16-2 Molecular Formula: C11H8ClNO2 Molecular Weight (g/mol): 221.64 MDL Number: MFCD00052205 InChI Key: HXEVQMXCHCDPSO-UHFFFAOYSA-N Synonym: 5-methyl-3-phenylisoxazole-4-carbonyl chloride,pmic chloride,unii-97ot2t1w6v,3-phenyl-5-methylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 5-methyl-3-phenyl,5-methyl-3-phenyl-4-isoxazolecarbonyl chloride,3-phenyl-5-methyl-isoxazole-4-carbonyl,pubchem8723,acmc-20am25,dsstox_cid_31452 PubChem CID: 85624 IUPAC Name: 5-methyl-3-phenyl-1,2-oxazole-4-carbonyl chloride SMILES: CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl

PubChem CID 85624
CAS 16883-16-2
Molecular Weight (g/mol) 221.64
MDL Number MFCD00052205
SMILES CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)Cl
Synonym 5-methyl-3-phenylisoxazole-4-carbonyl chloride,pmic chloride,unii-97ot2t1w6v,3-phenyl-5-methylisoxazole-4-carbonyl chloride,4-isoxazolecarbonyl chloride, 5-methyl-3-phenyl,5-methyl-3-phenyl-4-isoxazolecarbonyl chloride,3-phenyl-5-methyl-isoxazole-4-carbonyl,pubchem8723,acmc-20am25,dsstox_cid_31452
IUPAC Name 5-methyl-3-phenyl-1,2-oxazole-4-carbonyl chloride
InChI Key HXEVQMXCHCDPSO-UHFFFAOYSA-N
Molecular Formula C11H8ClNO2
7

(4-Methyl-2-phenyl-1,3-thiazol-5-yl)methanol, 97%, Thermo Scientific™

CAS: 61291-91-6 Molecular Formula: C11H11NOS Molecular Weight (g/mol): 205.275 MDL Number: MFCD01928782 InChI Key: JSIPFWSPCWZJIU-UHFFFAOYSA-N Synonym: 4-methyl-2-phenyl-1,3-thiazol-5-yl methanol,4-methyl-2-phenylthiazol-5-yl methanol,4-methyl-2-phenyl-thiazol-5-yl-methanol,4-methyl-2-phenyl-1,3-thiazol-5-yl methan-1-ol,4-methyl-2-phenyl-5-thiazolemethanol,5-hydroxymethyl-4-methyl-2-phenylthiazole PubChem CID: 736541 IUPAC Name: (4-methyl-2-phenyl-1,3-thiazol-5-yl)methanol SMILES: CC1=C(SC(=N1)C2=CC=CC=C2)CO

PubChem CID 736541
CAS 61291-91-6
Molecular Weight (g/mol) 205.275
MDL Number MFCD01928782
SMILES CC1=C(SC(=N1)C2=CC=CC=C2)CO
Synonym 4-methyl-2-phenyl-1,3-thiazol-5-yl methanol,4-methyl-2-phenylthiazol-5-yl methanol,4-methyl-2-phenyl-thiazol-5-yl-methanol,4-methyl-2-phenyl-1,3-thiazol-5-yl methan-1-ol,4-methyl-2-phenyl-5-thiazolemethanol,5-hydroxymethyl-4-methyl-2-phenylthiazole
IUPAC Name (4-methyl-2-phenyl-1,3-thiazol-5-yl)methanol
InChI Key JSIPFWSPCWZJIU-UHFFFAOYSA-N
Molecular Formula C11H11NOS
8

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
10

6-chloroimidazo[1,2-b]pyridazine-2-carboxylic acid, 90%, Thermo Scientific™

CAS: 14714-24-0 Molecular Formula: C7H4ClN3O2 Molecular Weight (g/mol): 197.578 MDL Number: MFCD04974055 InChI Key: HTUZJYQXKFDVLT-UHFFFAOYSA-N Synonym: 6-chloroimidazo 1,2-b pyridazine-2-carboxylic acid,2-carboxy-6-chloroimidazo 1,2-b pyridazine,6-chloro-imidazo 1,2-b pyridazine-2-carboxylic acid,pubchem23037,6-chloroimidazo 1,2-b pyridazine-2-carboxylicacid,6-chloro-2-imidazo 1,2-b pyridazinecarboxylic acid,6-chloranylimidazo 1,2-b pyridazine-2-carboxylic acid,imidazo 1,2-b pyridazine-2-carboxylicacid, 6-chloro,6-chloro-4-hydroimidazo 1,2-e pyridazine-2-carboxylic acid,imidazo 1,2-b pyridazine-2-carboxylic acid, 6-chloro PubChem CID: 2794637 IUPAC Name: 6-chloroimidazo[1,2-b]pyridazine-2-carboxylic acid SMILES: C1=CC(=NN2C1=NC(=C2)C(=O)O)Cl

PubChem CID 2794637
CAS 14714-24-0
Molecular Weight (g/mol) 197.578
MDL Number MFCD04974055
SMILES C1=CC(=NN2C1=NC(=C2)C(=O)O)Cl
Synonym 6-chloroimidazo 1,2-b pyridazine-2-carboxylic acid,2-carboxy-6-chloroimidazo 1,2-b pyridazine,6-chloro-imidazo 1,2-b pyridazine-2-carboxylic acid,pubchem23037,6-chloroimidazo 1,2-b pyridazine-2-carboxylicacid,6-chloro-2-imidazo 1,2-b pyridazinecarboxylic acid,6-chloranylimidazo 1,2-b pyridazine-2-carboxylic acid,imidazo 1,2-b pyridazine-2-carboxylicacid, 6-chloro,6-chloro-4-hydroimidazo 1,2-e pyridazine-2-carboxylic acid,imidazo 1,2-b pyridazine-2-carboxylic acid, 6-chloro
IUPAC Name 6-chloroimidazo[1,2-b]pyridazine-2-carboxylic acid
InChI Key HTUZJYQXKFDVLT-UHFFFAOYSA-N
Molecular Formula C7H4ClN3O2
11

Methyl 1-methyl-1H-imidazole-4-carboxylate, 97%, Thermo Scientific™

CAS: 17289-19-9 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.142 MDL Number: MFCD02179561 InChI Key: KZPZTVKOJSKVBV-UHFFFAOYSA-N Synonym: methyl 1-methyl-1h-imidazole-4-carboxylate,1-methyl-1h-imidazole-4-carboxylic acid methyl ester,1h-imidazole-4-carboxylic acid, 1-methyl-, methyl ester,pubchem9002,acmc-209e5g,methyl1-methyl-1h-imidazole-4-carboxylate,ksc534i0d,methyl 1-methylimidazol-4-carboxylate,methyl 1-methyl-1h-imidazole-carboxylate,4-methoxycarbonyl-1-methyl-1h-imidazole PubChem CID: 2773510 IUPAC Name: methyl 1-methylimidazole-4-carboxylate SMILES: CN1C=C(N=C1)C(=O)OC

PubChem CID 2773510
CAS 17289-19-9
Molecular Weight (g/mol) 140.142
MDL Number MFCD02179561
SMILES CN1C=C(N=C1)C(=O)OC
Synonym methyl 1-methyl-1h-imidazole-4-carboxylate,1-methyl-1h-imidazole-4-carboxylic acid methyl ester,1h-imidazole-4-carboxylic acid, 1-methyl-, methyl ester,pubchem9002,acmc-209e5g,methyl1-methyl-1h-imidazole-4-carboxylate,ksc534i0d,methyl 1-methylimidazol-4-carboxylate,methyl 1-methyl-1h-imidazole-carboxylate,4-methoxycarbonyl-1-methyl-1h-imidazole
IUPAC Name methyl 1-methylimidazole-4-carboxylate
InChI Key KZPZTVKOJSKVBV-UHFFFAOYSA-N
Molecular Formula C6H8N2O2
12

4-(2-Bromoethyl)-3,5-dimethyl-1H-pyrazole, 97%, Thermo Scientific™

CAS: 83467-28-1 Molecular Formula: C7H11BrN2 Molecular Weight (g/mol): 203.08 MDL Number: MFCD00480987 InChI Key: HGGLMDBNLJUEKA-UHFFFAOYSA-N Synonym: 4-2-bromoethyl-3,5-dimethyl-1h-pyrazole,4-2-bromo-ethyl-3,5-dimethyl-1h-pyrazole,3,5-dimethyl-4-2-bromoethyl-1h-pyrazole,4-2-bromoethyl-3,5-dimethyl-1h-pyrazol,1h-pyrazole, 4-2-bromoethyl-3,5-dimethyl,4-2-bromoethyl-3,5-dimethylpyrazole,akos pao-0750,pubchem12761,timtec-bb sbb010155,aronis23735 PubChem CID: 572879 IUPAC Name: 4-(2-bromoethyl)-3,5-dimethyl-1H-pyrazole SMILES: CC1=C(CCBr)C(C)=NN1

PubChem CID 572879
CAS 83467-28-1
Molecular Weight (g/mol) 203.08
MDL Number MFCD00480987
SMILES CC1=C(CCBr)C(C)=NN1
Synonym 4-2-bromoethyl-3,5-dimethyl-1h-pyrazole,4-2-bromo-ethyl-3,5-dimethyl-1h-pyrazole,3,5-dimethyl-4-2-bromoethyl-1h-pyrazole,4-2-bromoethyl-3,5-dimethyl-1h-pyrazol,1h-pyrazole, 4-2-bromoethyl-3,5-dimethyl,4-2-bromoethyl-3,5-dimethylpyrazole,akos pao-0750,pubchem12761,timtec-bb sbb010155,aronis23735
IUPAC Name 4-(2-bromoethyl)-3,5-dimethyl-1H-pyrazole
InChI Key HGGLMDBNLJUEKA-UHFFFAOYSA-N
Molecular Formula C7H11BrN2
13

Methyle1-methyl-1H-imidazole-5-carboxylate, 97%, Thermo Scientific™

CAS: 17289-20-2 Molecular Formula: C6H8N2O2 Molecular Weight (g/mol): 140.14 MDL Number: MFCD01567300 InChI Key: AKDPLDCXQNEMCL-UHFFFAOYSA-N Synonym: methyl 1-methyl-1h-imidazole-5-carboxylate,methyl 1-methylimidazole-5-carboxylate,methyl1-methyl-1h-imidazole-5-carboxylate,3-methyl-3h-imidazole-4-carboxylic acid methyl ester,1h-imidazole-5-carboxylic acid, 1-methyl-, methyl ester,1-methyl-1h-imidazole-5-carboxylic acid methyl ester,pubchem9004,acmc-209e5h,1-methylimidazole-5-carboxylic acid methyl ester,1h-imidazole-5-carboxylicacid, 1-methyl-, methyl ester PubChem CID: 2736896 IUPAC Name: methyl 3-methylimidazole-4-carboxylate SMILES: COC(=O)C1=CN=CN1C

PubChem CID 2736896
CAS 17289-20-2
Molecular Weight (g/mol) 140.14
MDL Number MFCD01567300
SMILES COC(=O)C1=CN=CN1C
Synonym methyl 1-methyl-1h-imidazole-5-carboxylate,methyl 1-methylimidazole-5-carboxylate,methyl1-methyl-1h-imidazole-5-carboxylate,3-methyl-3h-imidazole-4-carboxylic acid methyl ester,1h-imidazole-5-carboxylic acid, 1-methyl-, methyl ester,1-methyl-1h-imidazole-5-carboxylic acid methyl ester,pubchem9004,acmc-209e5h,1-methylimidazole-5-carboxylic acid methyl ester,1h-imidazole-5-carboxylicacid, 1-methyl-, methyl ester
IUPAC Name methyl 3-methylimidazole-4-carboxylate
InChI Key AKDPLDCXQNEMCL-UHFFFAOYSA-N
Molecular Formula C6H8N2O2
14

(1-Methyl-1H-indazol-3-yl)methylamine dihydrochloride, 97%, Thermo Scientific™

CAS: 1093860-45-7 Molecular Formula: C9H13Cl2N3 Molecular Weight (g/mol): 234.124 MDL Number: MFCD11841065 InChI Key: ZHWICCCSNYFLJY-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazol-3-yl methylamine dihydrochloride,1-methylindazol-3-yl methanamine dihydrochloride,1-methyl-1h-indazol-3-yl methanamine dihydrochloride,3-aminomethyl-1-methyl-1h-indazole dihydrochloride,1-methyl-1h-indazol-3-yl methylamine 2hcl,1-methyl-1h-indazol-3-yl methylamine, chloride, chloride,1-1-methylindazol-3-yl methanamine dihydrochloride,1-1-methyl-1h-indazol-3-yl methanamine-hydrogen chloride 1/2 PubChem CID: 43811028 IUPAC Name: (1-methylindazol-3-yl)methanamine;dihydrochloride SMILES: CN1C2=CC=CC=C2C(=N1)CN.Cl.Cl

PubChem CID 43811028
CAS 1093860-45-7
Molecular Weight (g/mol) 234.124
MDL Number MFCD11841065
SMILES CN1C2=CC=CC=C2C(=N1)CN.Cl.Cl
Synonym 1-methyl-1h-indazol-3-yl methylamine dihydrochloride,1-methylindazol-3-yl methanamine dihydrochloride,1-methyl-1h-indazol-3-yl methanamine dihydrochloride,3-aminomethyl-1-methyl-1h-indazole dihydrochloride,1-methyl-1h-indazol-3-yl methylamine 2hcl,1-methyl-1h-indazol-3-yl methylamine, chloride, chloride,1-1-methylindazol-3-yl methanamine dihydrochloride,1-1-methyl-1h-indazol-3-yl methanamine-hydrogen chloride 1/2
IUPAC Name (1-methylindazol-3-yl)methanamine;dihydrochloride
InChI Key ZHWICCCSNYFLJY-UHFFFAOYSA-N
Molecular Formula C9H13Cl2N3
15

2-Methyl-4-phenyl-1,3-thiazole-5-carboxylic acid, 97%, Thermo Scientific™

CAS: 32002-72-5 Molecular Formula: C11H8NO2S Molecular Weight (g/mol): 218.25 MDL Number: MFCD07348569 InChI Key: APXSARIYDLVPAY-UHFFFAOYSA-M Synonym: 2-methyl-4-phenylthiazole-5-carboxylic acid,2-methy-4-phenylthiazol-5-ylcarboxylic acid,2-methyl-4-phenyl-thiazole-5-carboxylic acid,2-methyl-4-phenylthiazol-5-ylcarboxylic acid,5-thiazolecarboxylicacid, 2-methyl-4-phenyl,5-thiazolecarboxylic acid, 2-methyl-4-phenyl PubChem CID: 7131132 IUPAC Name: 2-methyl-4-phenyl-1,3-thiazole-5-carboxylic acid SMILES: CC1=NC(=C(S1)C([O-])=O)C1=CC=CC=C1

PubChem CID 7131132
CAS 32002-72-5
Molecular Weight (g/mol) 218.25
MDL Number MFCD07348569
SMILES CC1=NC(=C(S1)C([O-])=O)C1=CC=CC=C1
Synonym 2-methyl-4-phenylthiazole-5-carboxylic acid,2-methy-4-phenylthiazol-5-ylcarboxylic acid,2-methyl-4-phenyl-thiazole-5-carboxylic acid,2-methyl-4-phenylthiazol-5-ylcarboxylic acid,5-thiazolecarboxylicacid, 2-methyl-4-phenyl,5-thiazolecarboxylic acid, 2-methyl-4-phenyl
IUPAC Name 2-methyl-4-phenyl-1,3-thiazole-5-carboxylic acid
InChI Key APXSARIYDLVPAY-UHFFFAOYSA-M
Molecular Formula C11H8NO2S