N-[[4-[ethyl-(phenylmethyl)amino]phenyl]methylideneamino]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[[4-[ethyl-(phenylmethyl)amino]phenyl]methylideneamino]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[[4-[benzyl(ethyl)amino]phenyl]methyleneamino]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[[4-[ethyl-(phenylmethyl)amino]phenyl]methylideneamino]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[[4-[benzyl(ethyl)amino]phenyl]methylideneamino]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[[4-[benzyl(ethyl)amino]benzylidene]amino]-2-(3-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=CN=CC=C5

Isomeric SMILES

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

InChI

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