Vitas-M small molecule compound
(5Z)-5-(4-methoxybenzylidene)-3-(3-{2-[(4-methylbenzyl)sulfanyl]-1H-benzimidazol-1-yl}-3-oxopropyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK823283
SMILES COc1ccc(cc1)/C=C/1\SC(=S)N(C1=O)CCC(=O)n1c(SCc2ccc(cc2)C)nc2c1cccc2
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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 C29H25N3O3S3 MW 559.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25N3O3S3/c1-19-7-9-21(10-8-19)18-37-28-30-23-5-3-4-6-24(23)32(28)26(33)15-16-31-27(34)25(38-29(31)36)17-20-11-13-22(35-2)14-12-20/h3-14,17H,15-16,18H2,1-2H3/b25-17-InChIKey
DEPPPBGLGIVCLV-UQQQWYQISA-NSynonyms
(5Z)5((4methoxyphenyl)methylidene)3(3(2((4methylphenyl)methylsulfanyl)benzimidazol1yl)3oxopropyl)2sulfanylidene13thiazolidin4one
(5Z)5(4methoxybenzylidene)3(3(2((4methylbenzyl)sulfanyl)1Hbenzimidazol1yl)3oxopropyl)2thioxo13thiazolidin4one
CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2C(=O)CCN4C(=O)C(=CC5=CC=C(C=C5)OC)SC4=S
COc1ccc(cc1)C=C1SC(=S)N(C1=O)CCC(=O)n1c(SCc2ccc(cc2)C)nc2c1cccc2
InChI=1SC29H25N3O3S3c1197921(10819)1837283023534624(23)32(28)26(33)15163127(34)25(3829(31)36)1720111322(352)141220h31417H151618H212H3b2517
MFCD03463817
ZINC000097947153
ZINC97947153
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