Vitas-M small molecule compound
3-{(5E)-5-[4-(methoxycarbonyl)benzylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}benzoic acid
Catalog ID
STK110659
SMILES COC(=O)c1ccc(cc1)/C=C\1/SC(=S)N(C1=O)c1cccc(c1)C(=O)O
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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 C19H13NO5S2 MW 399.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13NO5S2/c1-25-18(24)12-7-5-11(6-8-12)9-15-16(21)20(19(26)27-15)14-4-2-3-13(10-14)17(22)23/h2-10H,1H3,(H,22,23)/b15-9+InChIKey
YYJPISKOPJUFCR-OQLLNIDSSA-NSynonyms
3((5E)5((4METHOXYCARBONYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BENZOICACID
3((5E)5(4(METHOXYCARBONYL)BENZYLIDENE)4OXO2THIOXO13THIAZOLIDIN3YL)BENZOICACID
COC(=O)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)C3=CC=CC(=C3)C(=O)O
COC(=O)c1ccc(cc1)C=C1SC(=S)N(C1=O)c1cccc(c1)C(=O)O
InChI=1SC19H13NO5S2c12518(24)127511(6812)91516(21)20(19(26)2715)1442313(1014)17(22)23h210H1H3(H2223)b159+
MFCD04084706
ZINC000012468209
ZINC12468209
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