ethyl 1-(4-methylquinolin-2-yl)-5-[(3-phenoxyphenyl)carbonylamino]pyrazole-4-carboxylate

Systemtic Name: ethyl 1-(4-methylquinolin-2-yl)-5-[(3-phenoxyphenyl)carbonylamino]pyrazole-4-carboxylate Openeye Name: ethyl 1-(4-methyl-2-quinolyl)-5-[(3-phenoxybenzoyl)amino]pyrazole-4-carboxylate CAS Name: 1-(4-methyl-2-quinolinyl)-5-[[oxo-(3-phenoxyphenyl)methyl]amino]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methylquinolin-2-yl)-5-[(3-phenoxybenzoyl)amino]pyrazole-4-carboxylate Traditional Name: 1-(4-methyl-2-quinolyl)-5-[(3-phenoxybenzoyl)amino]pyrazole-4-carboxylic acid ethyl ester Formula: C29H24N4O4 MolecularWeight: 492.52526

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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(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC3=CC=CC=C3C(=C2)C)NC(=O)C4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H24N4O4/c1-3-36-29(35)24-18-30-33(26-16-19(2)23-14-7-8-15-25(23)31-26)27(24)32-28(34)20-10-9-13-22(17-20)37-21-11-5-4-6-12-21/h4-18H,3H2,1-2H3,(H,32,34)