[4-[(3-methylphenyl)methyl]piperazin-1-yl]-(2-pyridin-3-ylquinolin-4-yl)methanone

Systemtic Name: [4-[(3-methylphenyl)methyl]piperazin-1-yl]-(2-pyridin-3-ylquinolin-4-yl)methanone Openeye Name: [4-(m-tolylmethyl)piperazin-1-yl]-[2-(3-pyridyl)-4-quinolyl]methanone CAS Name: [4-[(3-methylphenyl)methyl]-1-piperazinyl]-[2-(3-pyridinyl)-4-quinolinyl]methanone IUPAC Name: [4-[(3-methylphenyl)methyl]piperazin-1-yl]-(2-pyridin-3-ylquinolin-4-yl)methanone Traditional Name: [4-(3-methylbenzyl)piperazino]-[2-(3-pyridyl)-4-quinolyl]methanone Formula: C27H26N4O MolecularWeight: 422.52154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5

InChI

InChI=1S/C27H26N4O/c1-20-6-4-7-21(16-20)19-30-12-14-31(15-13-30)27(32)24-17-26(22-8-5-11-28-18-22)29-25-10-3-2-9-23(24)25/h2-11,16-18H,12-15,19H2,1H3