Vitas-M small molecule compound
ethyl (4Z)-4-(2-chlorobenzylidene)-1-(4-ethoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Catalog ID
STK168460
SMILES CCOC(=O)C1=C(C)N(C(=O)/C/1=C\c1ccccc1Cl)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/c1-4-28-18-12-10-17(11-13-18)25-15(3)21(23(27)29-5-2)19(22(25)26)14-16-8-6-7-9-20(16)24/h6-14H,4-5H2,1-3H3/b19-14-InChIKey
MCZIRAPKFFDBQQ-RGEXLXHISA-NSynonyms
CCOC(=O)C1=C(C)N(C(=O)C1=Cc1ccccc1Cl)c1ccc(cc1)OCC
CCOC1=CC=C(C=C1)N2C(=C(C(=CC3=CC=CC=C3Cl)C2=O)C(=O)OCC)C
ETHYL(4Z)4((2CHLOROPHENYL)METHYLIDENE)1(4ETHOXYPHENYL)2METHYL5OXOPYRROLE3CARBOXYLATE
ETHYL(4Z)4(2CHLOROBENZYLIDENE)1(4ETHOXYPHENYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
ETHYL4(2CHLOROBENZYLIDENE)1(4ETHOXYPHENYL)2METHYL5OXO45DIHYDRO1HPYRROLE3CARBOXYLATE
InChI=1SC23H22ClNO4c142818121017(111318)2515(3)21(23(27)2952)19(22(25)26)1416867920(16)24h614H45H213H3b1914
MFCD03269830
ZINC000000660199
ZINC00660199
ZINC660199
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