N-[(2-methylpyrazol-3-yl)-phenyl-methyl]-3-oxidanyl-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[(2-methylpyrazol-3-yl)-phenyl-methyl]-3-oxidanyl-2-phenyl-quinoline-4-carboxamide Openeye Name: 3-hydroxy-N-[(2-methylpyrazol-3-yl)-phenyl-methyl]-2-phenyl-quinoline-4-carboxamide CAS Name: 3-hydroxy-N-[(2-methyl-3-pyrazolyl)-phenylmethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: 3-hydroxy-N-[(2-methylpyrazol-3-yl)-phenylmethyl]-2-phenylquinoline-4-carboxamide Traditional Name: 3-hydroxy-N-[(2-methylpyrazol-3-yl)-phenyl-methyl]-2-phenyl-cinchoninamide Formula: C27H22N4O2 MolecularWeight: 434.48918

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C(C2=CC=CC=C2)NC(=O)C3=C(C(=NC4=CC=CC=C43)C5=CC=CC=C5)O

Isomeric SMILES

CN1C(=CC=N1)C(C2=CC=CC=C2)NC(=O)C3=C(C(=NC4=CC=CC=C43)C5=CC=CC=C5)O

InChI

InChI=1S/C27H22N4O2/c1-31-22(16-17-28-31)24(18-10-4-2-5-11-18)30-27(33)23-20-14-8-9-15-21(20)29-25(26(23)32)19-12-6-3-7-13-19/h2-17,24,32H,1H3,(H,30,33)