Vitas-M small molecule compound

methyl [(5E)-5-(3-chloro-4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]acetate

Catalog ID
STK152353
SMILES COC(=O)CN1C(=O)S/C(=C/c2ccc(c(c2)Cl)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 C14H12ClNO5S MW 341.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12ClNO5S/c1-20-10-4-3-8(5-9(10)15)6-11-13(18)16(14(19)22-11)7-12(17)21-2/h3-6H,7H2,1-2H3/b11-6+
InChIKey
FCPFIZBQLBGBAM-IZZDOVSWSA-N
Synonyms

COC(=O)CN1C(=O)SC(=Cc2ccc(c(c2)Cl)OC)C1=O
COC1=C(C=C(C=C1)C=C2C(=O)N(C(=O)S2)CC(=O)OC)Cl
InChI=1SC14H12ClNO5Sc12010438(59(10)15)61113(18)16(14(19)2211)712(17)212h36H7H212H3b116+
METHYL((5E)5(3CHLORO4METHOXYBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
METHYL2((5E)5((3CHLORO4METHOXYPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)ACETATE
MFCD03273205
ZINC000004694749
ZINC04694749
ZINC4694749

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Available files

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