Vitas-M small molecule compound

methyl 4-({[(5Z)-5-(2-chlorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]methyl}amino)benzoate

Catalog ID
STL170085
SMILES COC(=O)c1ccc(cc1)NCN1C(=O)S/C(=C\c2ccccc2Cl)/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 C19H15ClN2O4S MW 402.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN2O4S/c1-26-18(24)12-6-8-14(9-7-12)21-11-22-17(23)16(27-19(22)25)10-13-4-2-3-5-15(13)20/h2-10,21H,11H2,1H3/b16-10-
InChIKey
UENVPBVMOAKTBH-YBEGLDIGSA-N
Synonyms

COC(=O)C1=CC=C(C=C1)NCN2C(=O)C(=CC3=CC=CC=C3Cl)SC2=O
COC(=O)c1ccc(cc1)NCN1C(=O)SC(=Cc2ccccc2Cl)C1=O
InChI=1SC19H15ClN2O4Sc12618(24)126814(9712)21112217(23)16(2719(22)25)1013423515(13)20h21021H11H21H3b1610
methyl4((((5Z)5(2chlorobenzylidene)24dioxo13thiazolidin3yl)methyl)amino)benzoate
METHYL4(((5Z)5((2CHLOROPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)METHYLAMINO)BENZOATE
MFCD00363013
ZINC000001510162
ZINC01510162
ZINC1510162

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.