Vitas-M small molecule compound
(4Z)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK821502
SMILES Cc1ccc(cc1)c1nn(cc1/C=C\1/C(=NN(C1=O)c1ccccc1)CSc1ccc(cc1)Cl)c1ccccc1
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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 C33H25ClN4OS MW 561.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H25ClN4OS/c1-23-12-14-24(15-13-23)32-25(21-37(36-32)27-8-4-2-5-9-27)20-30-31(22-40-29-18-16-26(34)17-19-29)35-38(33(30)39)28-10-6-3-7-11-28/h2-21H,22H2,1H3/b30-20-InChIKey
VLXCDEHKWGRABL-COEJQBHMSA-NSynonyms
(4Z)5(((4chlorophenyl)sulfanyl)methyl)4((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2phenyl24dihydro3Hpyrazol3one
(4Z)5((4chlorophenyl)sulfanylmethyl)4((3(4methylphenyl)1phenylpyrazol4yl)methylidene)2phenylpyrazol3one
CC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)CSC5=CC=C(C=C5)Cl)C6=CC=CC=C6
Cc1ccc(cc1)c1nn(cc1C=C1C(=NN(C1=O)c1ccccc1)CSc1ccc(cc1)Cl)c1ccccc1
InChI=1SC33H25ClN4OSc123121424(151323)3225(2137(3632)278425927)203031(224029181626(34)171929)3538(33(30)39)28106371128h221H22H21H3b3020
MFCD03462849
ZINC000097946932
ZINC97946932
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