Vitas-M small molecule compound
(5Z)-5-[(3-{4-[(2-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)methylidene]-3-(4-methylbenzyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK810833
SMILES Cc1ccc(cc1)CN1C(=S)S/C(=C\c2cn(nc2c2ccc(cc2)OCc2ccccc2Cl)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 C34H26ClN3O2S2 MW 608.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H26ClN3O2S2/c1-23-11-13-24(14-12-23)20-37-33(39)31(42-34(37)41)19-27-21-38(28-8-3-2-4-9-28)36-32(27)25-15-17-29(18-16-25)40-22-26-7-5-6-10-30(26)35/h2-19,21H,20,22H2,1H3/b31-19-InChIKey
STIGGGDTHZNWKA-DXJNIWACSA-NSynonyms
(5Z)5((3(4((2chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)methylidene)3(4methylbenzyl)2thioxo13thiazolidin4one
(5Z)5((3(4((2chlorophenyl)methoxy)phenyl)1phenylpyrazol4yl)methylidene)3((4methylphenyl)methyl)2sulfanylidene13thiazolidin4one
CC1=CC=C(C=C1)CN2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)OCC5=CC=CC=C5Cl)C6=CC=CC=C6)SC2=S
Cc1ccc(cc1)CN1C(=S)SC(=Cc2cn(nc2c2ccc(cc2)OCc2ccccc2Cl)c2ccccc2)C1=O
InChI=1SC34H26ClN3O2S2c123111324(141223)203733(39)31(4234(37)41)19272138(288324928)3632(27)25151729(181625)4022267561030(26)35h21921H2022H21H3b3119
MFCD03933048
ZINC000100840508
ZINC100840508
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