1-adamantyl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone dichloride

Systemtic Name: 1-adamantyl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone dichloride Openeye Name: 1-adamantyl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone dichloride CAS Name: 1-adamantyl-[4-(2-pyrimidinyl)-1-piperazinyl]methanone dichloride IUPAC Name: 1-adamantyl-(4-pyrimidin-2-ylpiperazin-1-yl)methanone dichloride Traditional Name: 1-adamantyl-[4-(2-pyrimidyl)piperazino]methanone dichloride Formula: C19H26Cl2N4O-2 MolecularWeight: 397.34194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C34CC5CC(C3)CC(C5)C4.[Cl-].[Cl-]

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C34CC5CC(C3)CC(C5)C4.[Cl-].[Cl-]

InChI

InChI=1S/C19H26N4O.2ClH/c24-17(19-11-14-8-15(12-19)10-16(9-14)13-19)22-4-6-23(7-5-22)18-20-2-1-3-21-18;;/h1-3,14-16H,4-13H2;2*1H/p-2