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

Systemtic Name: (8-methyl-2-pyridin-3-yl-quinolin-4-yl)-[4-(phenylmethyl)piperazin-1-yl]methanone Openeye Name: (4-benzylpiperazin-1-yl)-[8-methyl-2-(3-pyridyl)-4-quinolyl]methanone CAS Name: [8-methyl-2-(3-pyridinyl)-4-quinolinyl]-[4-(phenylmethyl)-1-piperazinyl]methanone IUPAC Name: (4-benzylpiperazin-1-yl)-(8-methyl-2-pyridin-3-ylquinolin-4-yl)methanone Traditional Name: (4-benzylpiperazino)-[8-methyl-2-(3-pyridyl)-4-quinolyl]methanone Formula: C27H26N4O MolecularWeight: 422.52154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CN=CC=C5

InChI

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