Vitas-M small molecule compound
2-[(5Z)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-4-methylpentanoic acid
Catalog ID
STL229406
SMILES CC(CC(N1C(=S)S/C(=C\c2nc3c([nH]2)cccc3)/C1=O)C(=O)O)C
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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 C17H17N3O3S2 MW 375.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3O3S2/c1-9(2)7-12(16(22)23)20-15(21)13(25-17(20)24)8-14-18-10-5-3-4-6-11(10)19-14/h3-6,8-9,12H,7H2,1-2H3,(H,18,19)(H,22,23)/b13-8-InChIKey
WUTPOPGJAZRACM-JYRVWZFOSA-NSynonyms
2((5Z)5(1Hbenzimidazol2ylmethylidene)4oxo2sulfanylidene13thiazolidin3yl)4methylpentanoicacid
2((5Z)5(1Hbenzimidazol2ylmethylidene)4oxo2thioxo13thiazolidin3yl)4methylpentanoicacid
CC(C)CC(C(=O)O)N1C(=O)C(=CC2=NC3=CC=CC=C3N2)SC1=S
CC(CC(N1C(=S)SC(=Cc2nc3c((nH)2)cccc3)C1=O)C(=O)O)C
InChI=1SC17H17N3O3S2c19(2)712(16(22)23)2015(21)13(2517(20)24)8141810534611(10)1914h368912H7H212H3(H1819)(H2223)b138
MFCD07421157
ZINC000005235944
ZINC000005235945
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