N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]adamantane-1-carboxamide

Systemtic Name: N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]adamantane-1-carboxamide Openeye Name: N-[(1-pyrimidin-2-yl-3-piperidyl)methyl]adamantane-1-carboxamide CAS Name: N-[[1-(2-pyrimidinyl)-3-piperidinyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]adamantane-1-carboxamide Traditional Name: N-[[1-(2-pyrimidyl)-3-piperidyl]methyl]adamantane-1-carboxamide Formula: C21H30N4O MolecularWeight: 354.4891

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)CNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC(CN(C1)C2=NC=CC=N2)CNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H30N4O/c26-19(21-10-16-7-17(11-21)9-18(8-16)12-21)24-13-15-3-1-6-25(14-15)20-22-4-2-5-23-20/h2,4-5,15-18H,1,3,6-14H2,(H,24,26)