Vitas-M small molecule compound
ethyl (2E)-2-[(2Z)-2-(3-benzyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)ethylidene]-1,3-diethyl-2,3-dihydro-1H-benzimidazole-5-carboxylate
Catalog ID
STK396559
SMILES CCOC(=O)c1ccc2c(c1)n(CC)/c(=C/C=C/1\SC(=S)N(C1=O)Cc1ccccc1)/n2CC
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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 C26H27N3O3S2 MW 493.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3S2/c1-4-27-20-13-12-19(25(31)32-6-3)16-21(20)28(5-2)23(27)15-14-22-24(30)29(26(33)34-22)17-18-10-8-7-9-11-18/h7-16H,4-6,17H2,1-3H3/b22-14-,23-15+InChIKey
FAEMIBLOKYLULJ-OQRYGUKSSA-NSynonyms
CCN1C2=C(C=C(C=C2)C(=O)OCC)N(C1=CC=C3C(=O)N(C(=S)S3)CC4=CC=CC=C4)CC
CCOC(=O)c1ccc2c(c1)n(CC)c(=CC=C1SC(=S)N(C1=O)Cc1ccccc1)n2CC
ETHYL(2E)2((2Z)2(3BENZYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)ETHYLIDENE)13DIETHYLBENZIMIDAZOLE5CARBOXYLATE
ethyl(2E)2((2Z)2(3benzyl4oxo2thioxo13thiazolidin5ylidene)ethylidene)13diethyl23dihydro1Hbenzimidazole5carboxylate
ETHYL13DIETHYL2(2(4OXO3BENZYL2THIOXO(13THIAZOLIDIN5YLIDENE))ETHYLIDENE)3HYDROBENZIMIDAZOLE5CARBOXYLATE
InChI=1SC26H27N3O3S2c142720131219(25(31)3263)1621(20)28(52)23(27)15142224(30)29(26(33)3422)1718108791118h716H4617H213H3b22142315+
MFCD00603625
ZINC000100549534
ZINC100549534
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