Vitas-M small molecule compound
ethyl 4-({(2E,5E)-3-ethyl-5-[(6-methyl-1,3-benzodioxol-5-yl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoate
Catalog ID
STK111840
SMILES CCOC(=O)c1ccc(cc1)/N=C\1/S/C(=C/c2cc3OCOc3cc2C)/C(=O)N1CC
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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 C23H22N2O5S MW 438.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O5S/c1-4-25-21(26)20(12-16-11-19-18(10-14(16)3)29-13-30-19)31-23(25)24-17-8-6-15(7-9-17)22(27)28-5-2/h6-12H,4-5,13H2,1-3H3/b20-12+,24-23+InChIKey
JJLYNWVIJDTCDV-KDUMPSMXSA-NSynonyms
CCOC(=O)c1ccc(cc1)N=C1SC(=Cc2cc3OCOc3cc2C)C(=O)N1CC
ethyl4(((2E5E)3ethyl5((6methyl13benzodioxol5yl)methylidene)4oxo13thiazolidin2ylidene)amino)benzoate
MFCD04127734
ZINC000101519904
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