Vitas-M small molecule compound
ethyl 2-({3-[(5E)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)-4,5-dimethylthiophene-3-carboxylate
Catalog ID
STL036072
SMILES CCOC(=O)c1c(NC(=O)CCN2C(=S)S/C(=C/c3ccco3)/C2=O)sc(c1C)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 C20H20N2O5S3 MW 464.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O5S3/c1-4-26-19(25)16-11(2)12(3)29-17(16)21-15(23)7-8-22-18(24)14(30-20(22)28)10-13-6-5-9-27-13/h5-6,9-10H,4,7-8H2,1-3H3,(H,21,23)/b14-10+InChIKey
AEZSPZNSHQYYSY-GXDHUFHOSA-NSynonyms
CCOC(=O)C1=C(SC(=C1C)C)NC(=O)CCN2C(=O)C(=CC3=CC=CO3)SC2=S
CCOC(=O)c1c(NC(=O)CCN2C(=S)SC(=Cc3ccco3)C2=O)sc(c1C)C
ethyl2((3((5E)5(furan2ylmethylidene)4oxo2thioxo13thiazolidin3yl)propanoyl)amino)45dimethylthiophene3carboxylate
ethyl2(3((5E)5(furan2ylmethylidene)4oxo2sulfanylidene13thiazolidin3yl)propanoylamino)45dimethylthiophene3carboxylate
InChI=1SC20H20N2O5S3c142619(25)1611(2)12(3)2917(16)2115(23)782218(24)14(3020(22)28)10136592713h56910H478H213H3(H2123)b1410+
MFCD18192314
ZINC000028296943
ZINC28296943
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