ethyl 5-[[2-(4-methylphenyl)quinolin-4-yl]carbonylamino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[[2-(4-methylphenyl)quinolin-4-yl]carbonylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-phenyl-5-[[2-(p-tolyl)quinoline-4-carbonyl]amino]pyrazole-4-carboxylate CAS Name: 5-[[[2-(4-methylphenyl)-4-quinolinyl]-oxomethyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(4-methylphenyl)quinoline-4-carbonyl]amino]-1-phenylpyrazole-4-carboxylate Traditional Name: 1-phenyl-5-[[2-(p-tolyl)quinoline-4-carbonyl]amino]pyrazole-4-carboxylic acid ethyl ester Formula: C29H24N4O3 MolecularWeight: 476.52586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)C

InChI

InChI=1S/C29H24N4O3/c1-3-36-29(35)24-18-30-33(21-9-5-4-6-10-21)27(24)32-28(34)23-17-26(20-15-13-19(2)14-16-20)31-25-12-8-7-11-22(23)25/h4-18H,3H2,1-2H3,(H,32,34)