[2-(1-adamantyl)pyridin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [2-(1-adamantyl)pyridin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(1-adamantyl)-4-pyridyl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [2-(1-adamantyl)-4-pyridinyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [2-(1-adamantyl)pyridin-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [2-(1-adamantyl)-4-pyridyl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C24H29N5O MolecularWeight: 403.51996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=NC=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C3=CC(=NC=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C24H29N5O/c30-22(28-6-8-29(9-7-28)23-26-3-1-4-27-23)20-2-5-25-21(13-20)24-14-17-10-18(15-24)12-19(11-17)16-24/h1-5,13,17-19H,6-12,14-16H2