Vitas-M small molecule compound
2-chloro-5-[(4Z)-4-(2,4-dichlorobenzylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Catalog ID
STK675338
SMILES Clc1ccc(c(c1)Cl)/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 C18H11Cl3N2O3 MW 409.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11Cl3N2O3/c1-9-13(6-10-2-3-11(19)7-16(10)21)17(24)23(22-9)12-4-5-15(20)14(8-12)18(25)26/h2-8H,1H3,(H,25,26)/b13-6-InChIKey
TXQFJFZRZGWYPG-MLPAPPSSSA-NSynonyms
2CHLORO5((4Z)4((24DICHLOROPHENYL)METHYLIDENE)3METHYL5OXOPYRAZOL1YL)BENZOICACID
2chloro5((4Z)4(24dichlorobenzylidene)3methyl5oxo45dihydro1Hpyrazol1yl)benzoicacid
5(4((24DICHLOROPHENYL)METHYLENE)3METHYL5OXO(12DIAZOLINYL))2CHLOROBENZOICACID
CC1=NN(C(=O)C1=CC2=C(C=C(C=C2)Cl)Cl)C3=CC(=C(C=C3)Cl)C(=O)O
Clc1ccc(c(c1)Cl)C=C1C(=NN(C1=O)c1ccc(c(c1)C(=O)O)Cl)C
InChI=1SC18H11Cl3N2O3c1913(6102311(19)716(10)21)17(24)23(229)124515(20)14(812)18(25)26h28H1H3(H2526)b136
MFCD01158522
ZINC000012412855
ZINC12412855
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