Vitas-M small molecule compound
ethyl 4-({[(5E)-5-(3,4-dimethoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetyl}amino)benzoate
Catalog ID
STL035929
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CN1C(=S)S/C(=C/c2ccc(c(c2)OC)OC)/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 C23H22N2O6S2 MW 486.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O6S2/c1-4-31-22(28)15-6-8-16(9-7-15)24-20(26)13-25-21(27)19(33-23(25)32)12-14-5-10-17(29-2)18(11-14)30-3/h5-12H,4,13H2,1-3H3,(H,24,26)/b19-12+InChIKey
DXGGEWBSSVXKTO-XDHOZWIPSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C(=O)C(=CC3=CC(=C(C=C3)OC)OC)SC2=S
CCOC(=O)c1ccc(cc1)NC(=O)CN1C(=S)SC(=Cc2ccc(c(c2)OC)OC)C1=O
ethyl4((((5E)5(34dimethoxybenzylidene)4oxo2thioxo13thiazolidin3yl)acetyl)amino)benzoate
ETHYL4((2((5E)5((34DIMETHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETYL)AMINO)BENZOATE
InChI=1SC23H22N2O6S2c143122(28)156816(9715)2420(26)132521(27)19(3323(25)32)121451017(292)18(1114)303h512H413H213H3(H2426)b1912+
MFCD18192252
ZINC000027530605
ZINC27530605
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