ethyl 1-(4-methylquinolin-2-yl)-5-[3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoylamino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-methylquinolin-2-yl)-5-[3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-(4-methyl-2-quinolyl)-5-[3-(3-oxo-4H-quinoxalin-2-yl)propanoylamino]pyrazole-4-carboxylate CAS Name: 1-(4-methyl-2-quinolinyl)-5-[[1-oxo-3-(3-oxo-4H-quinoxalin-2-yl)propyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylquinolin-2-yl)-5-[3-(3-oxo-4H-quinoxalin-2-yl)propanoylamino]pyrazole-4-carboxylate Traditional Name: 5-[3-(3-keto-4H-quinoxalin-2-yl)propanoylamino]-1-(4-methyl-2-quinolyl)pyrazole-4-carboxylic acid ethyl ester Formula: C27H24N6O4 MolecularWeight: 496.51726

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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)CCC4=NC5=CC=CC=C5NC4=O

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)CCC4=NC5=CC=CC=C5NC4=O

InChI

InChI=1S/C27H24N6O4/c1-3-37-27(36)18-15-28-33(23-14-16(2)17-8-4-5-9-19(17)30-23)25(18)32-24(34)13-12-22-26(35)31-21-11-7-6-10-20(21)29-22/h4-11,14-15H,3,12-13H2,1-2H3,(H,31,35)(H,32,34)