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

Systemtic Name: [2-[(2-ethylphenyl)amino]quinolin-4-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(2-ethylanilino)-4-quinolyl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [2-(2-ethylanilino)-4-quinolinyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [2-(2-ethylanilino)quinolin-4-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(2-ethylanilino)-4-quinolyl]-[4-(2-pyridyl)piperazino]methanone Formula: C27H27N5O MolecularWeight: 437.53618

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C27H27N5O/c1-2-20-9-3-5-11-23(20)29-25-19-22(21-10-4-6-12-24(21)30-25)27(33)32-17-15-31(16-18-32)26-13-7-8-14-28-26/h3-14,19H,2,15-18H2,1H3,(H,29,30)