Vitas-M small molecule compound
4-({4-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)benzoic acid
Catalog ID
STL035350
SMILES O=C(Nc1ccc(cc1)C(=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 C19H16N2O4S3 MW 432.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O4S3/c22-16(20-13-7-5-12(6-8-13)18(24)25)4-1-9-21-17(23)15(28-19(21)26)11-14-3-2-10-27-14/h2-3,5-8,10-11H,1,4,9H2,(H,20,22)(H,24,25)/b15-11-InChIKey
IJMKESOCHONJBW-PTNGSMBKSA-NSynonyms
4((4((5Z)4oxo5(thiophen2ylmethylidene)2thioxo13thiazolidin3yl)butanoyl)amino)benzoicacid
4(4((5Z)4OXO2SULFANYLIDENE5(THIOPHEN2YLMETHYLIDENE)13THIAZOLIDIN3YL)BUTANOYLAMINO)BENZOICACID
C1=CSC(=C1)C=C2C(=O)N(C(=S)S2)CCCC(=O)NC3=CC=C(C=C3)C(=O)O
InChI=1SC19H16N2O4S3c2216(20137512(6813)18(24)25)4192117(23)15(2819(21)26)111432102714h23581011H149H2(H2022)(H2425)b1511
MFCD02732599
O=C(Nc1ccc(cc1)C(=O)O)CCCN1C(=S)SC(=Cc2cccs2)C1=O
ZINC000001798933
ZINC1798933
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