Vitas-M small molecule compound
2-chloro-5-[(4Z)-4-(3-methoxybenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Catalog ID
STK376458
SMILES COc1cccc(c1)/C=C\1/C(=NN(C1=O)c1ccc(c(c1)C(=O)O)Cl)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H15ClN2O4 MW 370.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN2O4/c1-11-15(9-12-4-3-5-14(8-12)26-2)18(23)22(21-11)13-6-7-17(20)16(10-13)19(24)25/h3-10H,1-2H3,(H,24,25)/b15-9-InChIKey
GKOZPXNSVSDMLQ-DHDCSXOGSA-NSynonyms
2CHLORO5((4Z)4((3METHOXYPHENYL)METHYLIDENE)3METHYL5OXOPYRAZOL1YL)BENZOICACID
2chloro5((4Z)4(3methoxybenzylidene)3methyl5oxo45dihydro1Hpyrazol1yl)benzoicacid
2CHLORO5(4((3METHOXYPHENYL)METHYLENE)3METHYL5OXO(12DIAZOLINYL))BENZOICACID
CC1=NN(C(=O)C1=CC2=CC(=CC=C2)OC)C3=CC(=C(C=C3)Cl)C(=O)O
COc1cccc(c1)C=C1C(=NN(C1=O)c1ccc(c(c1)C(=O)O)Cl)C
InChI=1SC19H15ClN2O4c11115(91243514(812)262)18(23)22(2111)136717(20)16(1013)19(24)25h310H12H3(H2425)b159
MFCD01158567
ZINC000004499172
ZINC4499172
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