Vitas-M small molecule compound

methyl 2-[(5E)-5-(2,4-dichlorobenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]propanoate

Catalog ID
STK155280
SMILES COC(=O)C(N1C(=O)S/C(=C/c2ccc(cc2Cl)Cl)/C1=O)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 C14H11Cl2NO4S MW 360.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H11Cl2NO4S/c1-7(13(19)21-2)17-12(18)11(22-14(17)20)5-8-3-4-9(15)6-10(8)16/h3-7H,1-2H3/b11-5+
InChIKey
FGJOCCXKVKLGSK-VZUCSPMQSA-N
Synonyms

CC(C(=O)OC)N1C(=O)C(=CC2=C(C=C(C=C2)Cl)Cl)SC1=O
COC(=O)C(N1C(=O)SC(=Cc2ccc(cc2Cl)Cl)C1=O)C
InChI=1SC14H11Cl2NO4Sc17(13(19)212)1712(18)11(2214(17)20)58349(15)610(8)16h37H12H3b115+
METHYL2((5E)5((24DICHLOROPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
METHYL2((5E)5(24DICHLOROBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
MFCD03720828
ZINC000004695294
ZINC000004695295

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Available files

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