[4-(1-adamantyl)piperazin-1-yl]-(6-methyl-2-pyridin-3-yl-quinolin-4-yl)methanone

Systemtic Name: [4-(1-adamantyl)piperazin-1-yl]-(6-methyl-2-pyridin-3-yl-quinolin-4-yl)methanone Openeye Name: [4-(1-adamantyl)piperazin-1-yl]-[6-methyl-2-(3-pyridyl)-4-quinolyl]methanone CAS Name: [4-(1-adamantyl)-1-piperazinyl]-[6-methyl-2-(3-pyridinyl)-4-quinolinyl]methanone IUPAC Name: [4-(1-adamantyl)piperazin-1-yl]-(6-methyl-2-pyridin-3-ylquinolin-4-yl)methanone Traditional Name: [4-(1-adamantyl)piperazino]-[6-methyl-2-(3-pyridyl)-4-quinolyl]methanone Formula: C30H34N4O MolecularWeight: 466.61716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)C45CC6CC(C4)CC(C6)C5)C7=CN=CC=C7

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)N3CCN(CC3)C45CC6CC(C4)CC(C6)C5)C7=CN=CC=C7

InChI

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