Vitas-M small molecule compound
2-({3-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)benzoic acid
Catalog ID
STL035309
SMILES O=C(Nc1ccccc1C(=O)O)CCN1C(=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 C18H14N2O4S3 MW 418.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O4S3/c21-15(19-13-6-2-1-5-12(13)17(23)24)7-8-20-16(22)14(27-18(20)25)10-11-4-3-9-26-11/h1-6,9-10H,7-8H2,(H,19,21)(H,23,24)/b14-10-InChIKey
PUWHBLFXJWGIFD-UVTDQMKNSA-NSynonyms
2((3((5Z)4oxo5(thiophen2ylmethylidene)2thioxo13thiazolidin3yl)propanoyl)amino)benzoicacid
2(3((5Z)4OXO2SULFANYLIDENE5(THIOPHEN2YLMETHYLIDENE)13THIAZOLIDIN3YL)PROPANOYLAMINO)BENZOICACID
2(3(4OXO5(2THIENYLMETHYLENE)2THIOXO13THIAZOLIDIN3YL)PROPANOYLAMINO)BENZOICACID
C1=CC=C(C(=C1)C(=O)O)NC(=O)CCN2C(=O)C(=CC3=CC=CS3)SC2=S
InChI=1SC18H14N2O4S3c2115(1913621512(13)17(23)24)782016(22)14(2718(20)25)10114392611h16910H78H2(H1921)(H2324)b1410
MFCD02165490
O=C(Nc1ccccc1C(=O)O)CCN1C(=S)SC(=Cc2cccs2)C1=O
ZINC000002451725
ZINC2451725
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