Vitas-M small molecule compound

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

Catalog ID
STK152782
SMILES COC(=O)C(N1C(=O)S/C(=C/c2ccc(cc2)C)/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 C15H15NO4S MW 305.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15NO4S/c1-9-4-6-11(7-5-9)8-12-13(17)16(15(19)21-12)10(2)14(18)20-3/h4-8,10H,1-3H3/b12-8+
InChIKey
NRZDKTXLKURYRQ-XYOKQWHBSA-N
Synonyms

CC1=CC=C(C=C1)C=C2C(=O)N(C(=O)S2)C(C)C(=O)OC
COC(=O)C(N1C(=O)SC(=Cc2ccc(cc2)C)C1=O)C
InChI=1SC15H15NO4Sc194611(759)81213(17)16(15(19)2112)10(2)14(18)203h4810H13H3b128+
methyl2((5E)5((4methylphenyl)methylidene)24dioxo13thiazolidin3yl)propanoate
METHYL2((5E)5(4METHYLBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
METHYL2(5(4METHYLBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
MFCD03784141
ZINC000000982007
ZINC000000982009

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Available files

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