Vitas-M small molecule compound
(5Z)-3-(4-methoxybenzyl)-5-{[3-(4-methoxy-2-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK811794
SMILES COc1ccc(cc1)CN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2C)OC)c2ccccc2)/C1=O
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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 C29H25N3O3S2 MW 527.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O3S2/c1-19-15-24(35-3)13-14-25(19)27-21(18-32(30-27)22-7-5-4-6-8-22)16-26-28(33)31(29(36)37-26)17-20-9-11-23(34-2)12-10-20/h4-16,18H,17H2,1-3H3/b26-16-InChIKey
PFVNNDLEWLSEOT-QQXSKIMKSA-NSynonyms
(5Z)3(4methoxybenzyl)5((3(4methoxy2methylphenyl)1phenyl1Hpyrazol4yl)methylidene)2thioxo13thiazolidin4one
(5Z)5((3(4METHOXY2METHYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)3((4METHOXYPHENYL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CC1=C(C=CC(=C1)OC)C2=NN(C=C2C=C3C(=O)N(C(=S)S3)CC4=CC=C(C=C4)OC)C5=CC=CC=C5
COc1ccc(cc1)CN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2C)OC)c2ccccc2)C1=O
InChI=1SC29H25N3O3S2c1191524(353)131425(19)2721(1832(3027)227546822)162628(33)31(29(36)3726)172091123(342)121020h41618H17H213H3b2616
MFCD06264931
ZINC000097946466
ZINC97946466
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