Vitas-M small molecule compound
(5Z)-5-(furan-2-ylmethylidene)-3-(3-{2-[(4-methylbenzyl)sulfanyl]-1H-benzimidazol-1-yl}-3-oxopropyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK797885
SMILES Cc1ccc(cc1)CSc1nc2c(n1C(=O)CCN1C(=S)S/C(=C\c3ccco3)/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 C26H21N3O3S3 MW 519.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N3O3S3/c1-17-8-10-18(11-9-17)16-34-25-27-20-6-2-3-7-21(20)29(25)23(30)12-13-28-24(31)22(35-26(28)33)15-19-5-4-14-32-19/h2-11,14-15H,12-13,16H2,1H3/b22-15-InChIKey
NADSJURPXRNIGB-JCMHNJIXSA-NSynonyms
(5Z)5(furan2ylmethylidene)3(3(2((4methylbenzyl)sulfanyl)1Hbenzimidazol1yl)3oxopropyl)2thioxo13thiazolidin4one
(5Z)5(FURAN2YLMETHYLIDENE)3(3(2((4METHYLPHENYL)METHYLSULFANYL)BENZIMIDAZOL1YL)3OXOPROPYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
CC1=CC=C(C=C1)CSC2=NC3=CC=CC=C3N2C(=O)CCN4C(=O)C(=CC5=CC=CO5)SC4=S
Cc1ccc(cc1)CSc1nc2c(n1C(=O)CCN1C(=S)SC(=Cc3ccco3)C1=O)cccc2
InChI=1SC26H21N3O3S3c11781018(11917)1634252720623721(20)29(25)23(30)12132824(31)22(3526(28)33)151954143219h2111415H121316H21H3b2215
MFCD03461795
ZINC000016700037
ZINC16700037
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