(E)-N-(2-aminophenyl)-3-[2-methoxy-4-[(phenylmethyl)amino]quinolin-6-yl]prop-2-enamide

Systemtic Name: (E)-N-(2-aminophenyl)-3-[2-methoxy-4-[(phenylmethyl)amino]quinolin-6-yl]prop-2-enamide Openeye Name: (E)-N-(2-aminophenyl)-3-[4-(benzylamino)-2-methoxy-6-quinolyl]prop-2-enamide CAS Name: (E)-N-(2-aminophenyl)-3-[2-methoxy-4-[(phenylmethyl)amino]-6-quinolinyl]-2-propenamide IUPAC Name: (E)-N-(2-aminophenyl)-3-[4-(benzylamino)-2-methoxyquinolin-6-yl]prop-2-enamide Traditional Name: (E)-N-(2-aminophenyl)-3-[4-(benzylamino)-2-methoxy-6-quinolyl]acrylamide Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C=C(C=C2)C=CC(=O)NC3=CC=CC=C3N)C(=C1)NCC4=CC=CC=C4

Isomeric SMILES

COC1=NC2=C(C=C(C=C2)/C=C/C(=O)NC3=CC=CC=C3N)C(=C1)NCC4=CC=CC=C4

InChI

InChI=1S/C26H24N4O2/c1-32-26-16-24(28-17-19-7-3-2-4-8-19)20-15-18(11-13-22(20)30-26)12-14-25(31)29-23-10-6-5-9-21(23)27/h2-16H,17,27H2,1H3,(H,28,30)(H,29,31)/b14-12+