Vitas-M small molecule compound

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

Catalog ID
STK155199
SMILES COC(=O)C(N1C(=O)S/C(=C/c2ccc(c(c2)C)OC)/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 C16H17NO5S MW 335.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO5S/c1-9-7-11(5-6-12(9)21-3)8-13-14(18)17(16(20)23-13)10(2)15(19)22-4/h5-8,10H,1-4H3/b13-8+
InChIKey
MPFSNAHWRVHXJR-MDWZMJQESA-N
Synonyms

CC1=C(C=CC(=C1)C=C2C(=O)N(C(=O)S2)C(C)C(=O)OC)OC
COC(=O)C(N1C(=O)SC(=Cc2ccc(c(c2)C)OC)C1=O)C
InChI=1SC16H17NO5Sc19711(5612(9)213)81314(18)17(16(20)2313)10(2)15(19)224h5810H14H3b138+
METHYL2((5E)5((4METHOXY3METHYLPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
METHYL2((5E)5(4METHOXY3METHYLBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
MFCD03923102
ZINC000001134367
ZINC000001134369

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Available files

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