Vitas-M small molecule compound
5-hydroxy-2-({4-[(5E)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid
Catalog ID
STK588058
SMILES O=C(Nc1ccc(cc1C(=O)O)O)CCCN1C(=S)S/C(=C/c2cccs2)/C1=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 C19H16N2O5S3 MW 448.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O5S3/c22-11-5-6-14(13(9-11)18(25)26)20-16(23)4-1-7-21-17(24)15(29-19(21)27)10-12-3-2-8-28-12/h2-3,5-6,8-10,22H,1,4,7H2,(H,20,23)(H,25,26)/b15-10+InChIKey
OUKIHDBZYUCFRN-XNTDXEJSSA-NSynonyms
892637-60-4(E)5hydroxy2(4(4oxo5(thiophen2ylmethylene)2thioxothiazolidin3yl)butanamido)benzoicacid
5hydroxy2((4((5E)4oxo5(thiophen2ylmethylidene)2thioxo13thiazolidin3yl)butanoyl)amino)benzoicacid
5hydroxy2(4((5E)4oxo2sulfanylidene5(thiophen2ylmethylidene)13thiazolidin3yl)butanoylamino)benzoicacid
892637604
C1=CSC(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=C(C=C(C=C3)O)C(=O)O
InChI=1SC19H16N2O5S3c22115614(13(911)18(25)26)2016(23)4172117(24)15(2919(21)27)10123282812h235681022H147H2(H2023)(H2526)b1510+
MFCD06787669
O=C(Nc1ccc(cc1C(=O)O)O)CCCN1C(=S)SC(=Cc2cccs2)C1=O
ZINC000009045850
ZINC9045850
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