Vitas-M small molecule compound

ethyl (4Z)-4-benzylidene-1-(4-ethoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate

Catalog ID
STK159984
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccccc1)c1ccc(cc1)OCC

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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 C23H23NO4 MW 377.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23NO4/c1-4-27-19-13-11-18(12-14-19)24-16(3)21(23(26)28-5-2)20(22(24)25)15-17-9-7-6-8-10-17/h6-15H,4-5H2,1-3H3/b20-15-
InChIKey
FXNNCXKSZWUCBN-HKWRFOASSA-N
Synonyms

(Z)ethyl4benzylidene1(4ethoxyphenyl)2methyl5oxo45dihydro1Hpyrrole3carboxylate
1(4ETHOXYPHENYL)2METHYL5OXO4(BENZYLIDENE)45DIHYDRO1HPYRROLE3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccccc1)c1ccc(cc1)OCC
CCOC1=CC=C(C=C1)N2C(=C(C(=CC3=CC=CC=C3)C2=O)C(=O)OCC)C
ETHYL(4Z)4BENZYLIDENE1(4ETHOXYPHENYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL(4Z)4BENZYLIDENE1(4ETHOXYPHENYL)2METHYL5OXOPYRROLE3CARBOXYLATE
InChI=1SC23H23NO4c142719131118(121419)2416(3)21(23(26)2852)20(22(24)25)151797681017h615H45H213H3b2015
MFCD01455463
ZINC000001196009
ZINC01196009
ZINC1196009

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Available files

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