[2-[(2,4-dimethoxyphenyl)amino]quinolin-4-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-[(2,4-dimethoxyphenyl)amino]quinolin-4-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(2,4-dimethoxyanilino)-4-quinolyl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [2-(2,4-dimethoxyanilino)-4-quinolinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [2-(2,4-dimethoxyanilino)quinolin-4-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(2,4-dimethoxyanilino)-4-quinolyl]-[4-(2-pyridyl)piperazino]methanone Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=N5)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=N5)OC

InChI

InChI=1S/C27H27N5O3/c1-34-19-10-11-23(24(17-19)35-2)30-25-18-21(20-7-3-4-8-22(20)29-25)27(33)32-15-13-31(14-16-32)26-9-5-6-12-28-26/h3-12,17-18H,13-16H2,1-2H3,(H,29,30)