Vitas-M small molecule compound

ethyl (5Z)-5-(4-ethoxy-3-methoxybenzylidene)-4-oxo-2-[(phenylcarbonyl)amino]-4,5-dihydrothiophene-3-carboxylate

Catalog ID
STK094770
SMILES CCOC(=O)C1=C(S/C(=C\c2ccc(c(c2)OC)OCC)/C1=O)NC(=O)c1ccccc1

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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 C24H23NO6S MW 453.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23NO6S/c1-4-30-17-12-11-15(13-18(17)29-3)14-19-21(26)20(24(28)31-5-2)23(32-19)25-22(27)16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3,(H,25,27)/b19-14-
InChIKey
AMMFKRFEDUYWKH-RGEXLXHISA-N
Synonyms

CCOC(=O)C1=C(SC(=Cc2ccc(c(c2)OC)OCC)C1=O)NC(=O)c1ccccc1
CCOC1=C(C=C(C=C1)C=C2C(=O)C(=C(S2)NC(=O)C3=CC=CC=C3)C(=O)OCC)OC
ETHYL(5Z)2BENZAMIDO5((4ETHOXY3METHOXYPHENYL)METHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ETHYL(5Z)5(4ETHOXY3METHOXYBENZYLIDENE)4OXO2((PHENYLCARBONYL)AMINO)45DIHYDROTHIOPHENE3CARBOXYLATE
InChI=1SC24H23NO6Sc143017121115(1318(17)293)141921(26)20(24(28)3152)23(3219)2522(27)1697681016h614H45H213H3(H2527)b1914
MFCD04086814
STK094770
ZINC000009296147
ZINC09296147
ZINC9296147

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Available files

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