N-[4-oxidanylidene-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]adamantane-1-carboxamide

Systemtic Name: N-[4-oxidanylidene-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]adamantane-1-carboxamide Openeye Name: N-[4-oxo-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]adamantane-1-carboxamide CAS Name: N-[4-oxo-4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-1-adamantanecarboxamide IUPAC Name: N-[4-oxo-4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]adamantane-1-carboxamide Traditional Name: N-[4-keto-4-[4-(2-pyrimidyl)piperazino]butyl]adamantane-1-carboxamide Formula: C23H33N5O2 MolecularWeight: 411.54042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCCNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCCNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H33N5O2/c29-20(27-7-9-28(10-8-27)22-25-5-2-6-26-22)3-1-4-24-21(30)23-14-17-11-18(15-23)13-19(12-17)16-23/h2,5-6,17-19H,1,3-4,7-16H2,(H,24,30)