ethyl 4-(4-fluorophenyl)-2-methyl-5-[2-[(6-methylpyridin-2-yl)amino]-2-oxidanylidene-ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-(4-fluorophenyl)-2-methyl-5-[2-[(6-methylpyridin-2-yl)amino]-2-oxidanylidene-ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(4-fluorophenyl)-2-methyl-5-[2-[(6-methyl-2-pyridyl)amino]-2-oxo-acetyl]-1H-pyrrole-3-carboxylate CAS Name: 4-(4-fluorophenyl)-2-methyl-5-[2-[(6-methyl-2-pyridinyl)amino]-1,2-dioxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-fluorophenyl)-2-methyl-5-[2-[(6-methylpyridin-2-yl)amino]-2-oxoacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-(4-fluorophenyl)-5-[2-keto-2-[(6-methyl-2-pyridyl)amino]acetyl]-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H20FN3O4 MolecularWeight: 409.410303

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)F)C(=O)C(=O)NC3=CC=CC(=N3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)F)C(=O)C(=O)NC3=CC=CC(=N3)C)C

InChI

InChI=1S/C22H20FN3O4/c1-4-30-22(29)17-13(3)25-19(18(17)14-8-10-15(23)11-9-14)20(27)21(28)26-16-7-5-6-12(2)24-16/h5-11,25H,4H2,1-3H3,(H,24,26,28)