[4-(2,3-dimethylphenyl)piperazin-1-yl]-(8-methyl-2-pyridin-3-yl-quinolin-4-yl)methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(8-methyl-2-pyridin-3-yl-quinolin-4-yl)methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[8-methyl-2-(3-pyridyl)-4-quinolyl]methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[8-methyl-2-(3-pyridinyl)-4-quinolinyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(8-methyl-2-pyridin-3-ylquinolin-4-yl)methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-[8-methyl-2-(3-pyridyl)-4-quinolyl]methanone Formula: C28H28N4O MolecularWeight: 436.54812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=C3C=CC=C4C)C5=CN=CC=C5)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=NC4=C3C=CC=C4C)C5=CN=CC=C5)C

InChI

InChI=1S/C28H28N4O/c1-19-7-5-11-26(21(19)3)31-13-15-32(16-14-31)28(33)24-17-25(22-9-6-12-29-18-22)30-27-20(2)8-4-10-23(24)27/h4-12,17-18H,13-16H2,1-3H3