N-[3-cyano-6-(dimethylamino)-4-[(phenylmethyl)amino]quinolin-2-yl]-4-methoxy-benzamide

Systemtic Name: N-[3-cyano-6-(dimethylamino)-4-[(phenylmethyl)amino]quinolin-2-yl]-4-methoxy-benzamide Openeye Name: N-[4-(benzylamino)-3-cyano-6-(dimethylamino)-2-quinolyl]-4-methoxy-benzamide CAS Name: N-[3-cyano-6-(dimethylamino)-4-[(phenylmethyl)amino]-2-quinolinyl]-4-methoxybenzamide IUPAC Name: N-[4-(benzylamino)-3-cyano-6-(dimethylamino)quinolin-2-yl]-4-methoxybenzamide Traditional Name: N-[4-(benzylamino)-3-cyano-6-(dimethylamino)-2-quinolyl]-4-methoxy-benzamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)N=C(C(=C2NCC3=CC=CC=C3)C#N)NC(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)N=C(C(=C2NCC3=CC=CC=C3)C#N)NC(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C27H25N5O2/c1-32(2)20-11-14-24-22(15-20)25(29-17-18-7-5-4-6-8-18)23(16-28)26(30-24)31-27(33)19-9-12-21(34-3)13-10-19/h4-15H,17H2,1-3H3,(H2,29,30,31,33)