N-[(E)-[4-[ethyl-(phenylmethyl)amino]phenyl]methylideneamino]-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[(E)-[4-[ethyl-(phenylmethyl)amino]phenyl]methylideneamino]-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-[(E)-[4-[benzyl(ethyl)amino]phenyl]methyleneamino]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[(E)-[4-[ethyl-(phenylmethyl)amino]phenyl]methylideneamino]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[(E)-[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-[(E)-[4-[benzyl(ethyl)amino]benzylidene]amino]-2-(2-pyridyl)cinchoninamide Formula: C31H27N5O MolecularWeight: 485.57898

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C=NNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)/C=N/NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

InChI

InChI=1S/C31H27N5O/c1-2-36(22-24-10-4-3-5-11-24)25-17-15-23(16-18-25)21-33-35-31(37)27-20-30(29-14-8-9-19-32-29)34-28-13-7-6-12-26(27)28/h3-21H,2,22H2,1H3,(H,35,37)/b33-21+