Vitas-M small molecule compound
ethyl (4Z)-4-(4-chlorobenzylidene)-1-(4-ethoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STL296458
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccc(cc1)Cl)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 C23H22ClNO4 MW 411.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClNO4/c1-4-28-19-12-10-18(11-13-19)25-15(3)21(23(27)29-5-2)20(22(25)26)14-16-6-8-17(24)9-7-16/h6-14H,4-5H2,1-3H3/b20-14-InChIKey
ZUIDRTDLTVYJKM-ZHZULCJRSA-NSynonyms
(Z)ethyl4(4chlorobenzylidene)1(4ethoxyphenyl)2methyl5oxo45dihydro1Hpyrrole3carboxylate
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccc(cc1)Cl)c1ccc(cc1)OCC
CCOC1=CC=C(C=C1)N2C(=C(C(=CC3=CC=C(C=C3)Cl)C2=O)C(=O)OCC)C
ETHYL(4Z)4((4CHLOROPHENYL)METHYLIDENE)1(4ETHOXYPHENYL)2METHYL5OXOPYRROLE3CARBOXYLATE
ethyl(4Z)4(4chlorobenzylidene)1(4ethoxyphenyl)2methyl5oxo45dihydro1Hpyrrole3carboxylate
InChI=1SC23H22ClNO4c142819121018(111319)2515(3)21(23(27)2952)20(22(25)26)14166817(24)9716h614H45H213H3b2014
MFCD01987784
ZINC000002306642
ZINC02306642
ZINC2306642
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