N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methyleneamino]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(E)-[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]methylideneamino]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)methylideneamino]-2-phenylquinoline-4-carboxamide Traditional Name: N-[(E)-(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methyleneamino]-2-phenyl-cinchoninamide Formula: C31H28N6O MolecularWeight: 500.59362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)N5CCCC5)C6=CC=CC=C6

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)N5CCCC5)C6=CC=CC=C6

InChI

InChI=1S/C31H28N6O/c1-22-27(31(36-18-10-11-19-36)37(35-22)24-14-6-3-7-15-24)21-32-34-30(38)26-20-29(23-12-4-2-5-13-23)33-28-17-9-8-16-25(26)28/h2-9,12-17,20-21H,10-11,18-19H2,1H3,(H,34,38)/b32-21+