N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]adamantane-1-carboxamide Openeye Name: N-[[6-(4-methylpiperazin-1-yl)-3-pyridyl]methyl]adamantane-1-carboxamide CAS Name: N-[[6-(4-methyl-1-piperazinyl)-3-pyridinyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[6-(4-methylpiperazin-1-yl)pyridin-3-yl]methyl]adamantane-1-carboxamide Traditional Name: N-[[6-(4-methylpiperazino)-3-pyridyl]methyl]adamantane-1-carboxamide Formula: C22H32N4O MolecularWeight: 368.51568

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)CNC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H32N4O/c1-25-4-6-26(7-5-25)20-3-2-16(14-23-20)15-24-21(27)22-11-17-8-18(12-22)10-19(9-17)13-22/h2-3,14,17-19H,4-13,15H2,1H3,(H,24,27)