ethyl 1-(4-methylquinolin-2-yl)-5-[(4-pyrrol-1-ylphenyl)carbonylamino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-methylquinolin-2-yl)-5-[(4-pyrrol-1-ylphenyl)carbonylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-(4-methyl-2-quinolyl)-5-[(4-pyrrol-1-ylbenzoyl)amino]pyrazole-4-carboxylate CAS Name: 1-(4-methyl-2-quinolinyl)-5-[[oxo-[4-(1-pyrrolyl)phenyl]methyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylquinolin-2-yl)-5-[(4-pyrrol-1-ylbenzoyl)amino]pyrazole-4-carboxylate Traditional Name: 1-(4-methyl-2-quinolyl)-5-[(4-pyrrol-1-ylbenzoyl)amino]pyrazole-4-carboxylic acid ethyl ester Formula: C27H23N5O3 MolecularWeight: 465.50322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)C4=CC=C(C=C4)N5C=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)C4=CC=C(C=C4)N5C=CC=C5

InChI

InChI=1S/C27H23N5O3/c1-3-35-27(34)22-17-28-32(24-16-18(2)21-8-4-5-9-23(21)29-24)25(22)30-26(33)19-10-12-20(13-11-19)31-14-6-7-15-31/h4-17H,3H2,1-2H3,(H,30,33)