[4-(1-adamantyl)piperazin-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone

Systemtic Name: [4-(1-adamantyl)piperazin-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone Openeye Name: [4-(1-adamantyl)piperazin-1-yl]-[2-(2-pyridyl)-4-quinolyl]methanone CAS Name: [4-(1-adamantyl)-1-piperazinyl]-[2-(2-pyridinyl)-4-quinolinyl]methanone IUPAC Name: [4-(1-adamantyl)piperazin-1-yl]-(2-pyridin-2-ylquinolin-4-yl)methanone Traditional Name: [4-(1-adamantyl)piperazino]-[2-(2-pyridyl)-4-quinolyl]methanone Formula: C29H32N4O MolecularWeight: 452.59058

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=N4)C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=N4)C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C29H32N4O/c34-28(24-16-27(26-7-3-4-8-30-26)31-25-6-2-1-5-23(24)25)32-9-11-33(12-10-32)29-17-20-13-21(18-29)15-22(14-20)19-29/h1-8,16,20-22H,9-15,17-19H2