Vitas-M small molecule compound
(5Z)-5-({3-[4-(benzyloxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-3-(1-phenylethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK823833
SMILES S=C1S/C(=C\c2cn(nc2c2ccc(cc2)OCc2ccccc2)c2ccccc2)/C(=O)N1C(c1ccccc1)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 C34H27N3O2S2 MW 573.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H27N3O2S2/c1-24(26-13-7-3-8-14-26)37-33(38)31(41-34(37)40)21-28-22-36(29-15-9-4-10-16-29)35-32(28)27-17-19-30(20-18-27)39-23-25-11-5-2-6-12-25/h2-22,24H,23H2,1H3/b31-21-InChIKey
KKIXNVUTKBGWAC-YQYKVWLJSA-NSynonyms
(5Z)3(1PHENYLETHYL)5((1PHENYL3(4PHENYLMETHOXYPHENYL)PYRAZOL4YL)METHYLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5((3(4(benzyloxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(1phenylethyl)2thioxo13thiazolidin4one
CC(C1=CC=CC=C1)N2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OCC5=CC=CC=C5)C6=CC=CC=C6)SC2=S
InChI=1SC34H27N3O2S2c124(26137381426)3733(38)31(4134(37)40)21282236(291594101629)3532(28)27171930(201827)392325115261225h22224H23H21H3b3121
MFCD06275608
S=C1SC(=Cc2cn(nc2c2ccc(cc2)OCc2ccccc2)c2ccccc2)C(=O)N1C(c1ccccc1)C
ZINC000097947193
ZINC000097947194
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