[4-[(4-ethylphenyl)methyl]piperazin-1-yl]-(6-methyl-2-pyridin-2-yl-quinolin-4-yl)methanone

Systemtic Name: [4-[(4-ethylphenyl)methyl]piperazin-1-yl]-(6-methyl-2-pyridin-2-yl-quinolin-4-yl)methanone Openeye Name: [4-[(4-ethylphenyl)methyl]piperazin-1-yl]-[6-methyl-2-(2-pyridyl)-4-quinolyl]methanone CAS Name: [4-[(4-ethylphenyl)methyl]-1-piperazinyl]-[6-methyl-2-(2-pyridinyl)-4-quinolinyl]methanone IUPAC Name: [4-[(4-ethylphenyl)methyl]piperazin-1-yl]-(6-methyl-2-pyridin-2-ylquinolin-4-yl)methanone Traditional Name: [4-(4-ethylbenzyl)piperazino]-[6-methyl-2-(2-pyridyl)-4-quinolyl]methanone Formula: C29H30N4O MolecularWeight: 450.5747

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=NC4=C3C=C(C=C4)C)C5=CC=CC=N5

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC(=NC4=C3C=C(C=C4)C)C5=CC=CC=N5

InChI

InChI=1S/C29H30N4O/c1-3-22-8-10-23(11-9-22)20-32-14-16-33(17-15-32)29(34)25-19-28(27-6-4-5-13-30-27)31-26-12-7-21(2)18-24(25)26/h4-13,18-19H,3,14-17,20H2,1-2H3