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

Systemtic Name: [4-(1-adamantyl)piperazin-1-yl]-(8-methyl-2-pyridin-4-yl-quinolin-4-yl)methanone Openeye Name: [4-(1-adamantyl)piperazin-1-yl]-[8-methyl-2-(4-pyridyl)-4-quinolyl]methanone CAS Name: [4-(1-adamantyl)-1-piperazinyl]-(8-methyl-2-pyridin-4-yl-4-quinolinyl)methanone IUPAC Name: [4-(1-adamantyl)piperazin-1-yl]-(8-methyl-2-pyridin-4-ylquinolin-4-yl)methanone Traditional Name: [4-(1-adamantyl)piperazino]-[8-methyl-2-(4-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=CC=NC=C7

Isomeric SMILES

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

InChI

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