Vitas-M small molecule compound
(5Z)-5-(4-fluorobenzylidene)-3-(3-{2-[(4-methylbenzyl)sulfanyl]-1H-benzimidazol-1-yl}-3-oxopropyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK702939
SMILES Cc1ccc(cc1)CSc1nc2c(n1C(=O)CCN1C(=S)S/C(=C\c3ccc(cc3)F)/C1=O)cccc2
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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 C28H22FN3O2S3 MW 547.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22FN3O2S3/c1-18-6-8-20(9-7-18)17-36-27-30-22-4-2-3-5-23(22)32(27)25(33)14-15-31-26(34)24(37-28(31)35)16-19-10-12-21(29)13-11-19/h2-13,16H,14-15,17H2,1H3/b24-16-InChIKey
SOHCRBHNVYWTDF-JLPGSUDCSA-NSynonyms
(5Z)5((4FLUOROPHENYL)METHYLIDENE)3(3(2((4METHYLPHENYL)METHYLSULFANYL)BENZIMIDAZOL1YL)3OXOPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(4fluorobenzylidene)3(3(2((4methylbenzyl)sulfanyl)1Hbenzimidazol1yl)3oxopropyl)2thioxo13thiazolidin4one
(E)5(4fluorobenzylidene)3(3(2((4methylbenzyl)thio)1Hbenzo(d)imidazol1yl)3oxopropyl)2thioxothiazolidin4one
CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2C(=O)CCN4C(=O)C(=CC5=CC=C(C=C5)F)SC4=S
Cc1ccc(cc1)CSc1nc2c(n1C(=O)CCN1C(=S)SC(=Cc3ccc(cc3)F)C1=O)cccc2
InChI=1SC28H22FN3O2S3c1186820(9718)1736273022423523(22)32(27)25(33)14153126(34)24(3728(31)35)1619101221(29)131119h21316H141517H21H3b2416
MFCD03461797
ZINC000050704726
ZINC50704726
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