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

Systemtic Name: ethyl 5-[[2-(2-chlorophenyl)quinolin-4-yl]carbonylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[[2-(2-chlorophenyl)-4-quinolinyl]-oxomethyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[[2-(2-chlorophenyl)quinoline-4-carbonyl]amino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C28H21ClN4O3 MolecularWeight: 496.94434

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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=CC=C5Cl

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5Cl

InChI

InChI=1S/C28H21ClN4O3/c1-2-36-28(35)22-17-30-33(18-10-4-3-5-11-18)26(22)32-27(34)21-16-25(20-13-6-8-14-23(20)29)31-24-15-9-7-12-19(21)24/h3-17H,2H2,1H3,(H,32,34)