Vitas-M small molecule compound

3-({(2E,5Z)-3-ethyl-5-[4-(methoxycarbonyl)benzylidene]-4-oxo-1,3-thiazolidin-2-ylidene}amino)benzoic acid

Catalog ID
STK743067
SMILES CCN1/C(=N\c2cccc(c2)C(=O)O)/S/C(=C\c2ccc(cc2)C(=O)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 C21H18N2O5S MW 410.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O5S/c1-3-23-18(24)17(11-13-7-9-14(10-8-13)20(27)28-2)29-21(23)22-16-6-4-5-15(12-16)19(25)26/h4-12H,3H2,1-2H3,(H,25,26)/b17-11-,22-21+
InChIKey
NCLFRUZVOROHQN-QDGHFPKDSA-N
Synonyms
675192-19-5
3(((2E5Z)3ethyl5(4(methoxycarbonyl)benzylidene)4oxo13thiazolidin2ylidene)amino)benzoicacid
3((E)((Z)3ethyl5(4(methoxycarbonyl)benzylidene)4oxothiazolidin2ylidene)amino)benzoicacid
675192195
CCN1C(=Nc2cccc(c2)C(=O)O)SC(=Cc2ccc(cc2)C(=O)OC)C1=O
MFCD03679053
ZINC000100316668

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Available files

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