N-[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)carbamoyl]phenyl]-2-(4-phenylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[3-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)carbamoyl]phenyl]-2-(4-phenylphenyl)quinoline-4-carboxamide Openeye Name: N-[3-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)carbamoyl]phenyl]-2-(4-phenylphenyl)quinoline-4-carboxamide CAS Name: N-[3-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-oxomethyl]phenyl]-2-(4-phenylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)carbamoyl]phenyl]-2-(4-phenylphenyl)quinoline-4-carboxamide Traditional Name: N-[3-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)carbamoyl]phenyl]-2-(4-phenylphenyl)cinchoninamide Formula: C40H31N5O3 MolecularWeight: 629.70584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=C(C=C6)C7=CC=CC=C7

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=C(C=C6)C7=CC=CC=C7

InChI

InChI=1S/C40H31N5O3/c1-26-37(40(48)45(44(26)2)32-16-7-4-8-17-32)43-38(46)30-14-11-15-31(24-30)41-39(47)34-25-36(42-35-19-10-9-18-33(34)35)29-22-20-28(21-23-29)27-12-5-3-6-13-27/h3-25H,1-2H3,(H,41,47)(H,43,46)