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

Systemtic Name: [4-(1-adamantyl)piperazin-1-yl]-(8-methyl-2-pyridin-3-yl-quinolin-4-yl)methanone Openeye Name: [4-(1-adamantyl)piperazin-1-yl]-[8-methyl-2-(3-pyridyl)-4-quinolyl]methanone CAS Name: [4-(1-adamantyl)-1-piperazinyl]-[8-methyl-2-(3-pyridinyl)-4-quinolinyl]methanone IUPAC Name: [4-(1-adamantyl)piperazin-1-yl]-(8-methyl-2-pyridin-3-ylquinolin-4-yl)methanone Traditional Name: [4-(1-adamantyl)piperazino]-[8-methyl-2-(3-pyridyl)-4-quinolyl]methanone Formula: C30H34N4O MolecularWeight: 466.61716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)C45CC6CC(C4)CC(C6)C5)C7=CN=CC=C7

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)C45CC6CC(C4)CC(C6)C5)C7=CN=CC=C7

InChI

InChI=1S/C30H34N4O/c1-20-4-2-6-25-26(15-27(32-28(20)25)24-5-3-7-31-19-24)29(35)33-8-10-34(11-9-33)30-16-21-12-22(17-30)14-23(13-21)18-30/h2-7,15,19,21-23H,8-14,16-18H2,1H3