N-[1-[5-(4-cyanophenyl)pyridin-2-yl]piperidin-3-yl]-4-oxidanyl-adamantane-1-carboxamide

Systemtic Name: N-[1-[5-(4-cyanophenyl)pyridin-2-yl]piperidin-3-yl]-4-oxidanyl-adamantane-1-carboxamide Openeye Name: N-[1-[5-(4-cyanophenyl)-2-pyridyl]-3-piperidyl]-4-hydroxy-adamantane-1-carboxamide CAS Name: N-[1-[5-(4-cyanophenyl)-2-pyridinyl]-3-piperidinyl]-4-hydroxy-1-adamantanecarboxamide IUPAC Name: N-[1-[5-(4-cyanophenyl)pyridin-2-yl]piperidin-3-yl]-4-hydroxyadamantane-1-carboxamide Traditional Name: N-[1-[5-(4-cyanophenyl)-2-pyridyl]-3-piperidyl]-4-hydroxy-adamantane-1-carboxamide Formula: C28H32N4O2 MolecularWeight: 456.57928

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=C(C=C2)C3=CC=C(C=C3)C#N)NC(=O)C45CC6CC(C4)C(C(C6)C5)O

Isomeric SMILES

C1CC(CN(C1)C2=NC=C(C=C2)C3=CC=C(C=C3)C#N)NC(=O)C45CC6CC(C4)C(C(C6)C5)O

InChI

InChI=1S/C28H32N4O2/c29-15-18-3-5-20(6-4-18)21-7-8-25(30-16-21)32-9-1-2-24(17-32)31-27(34)28-12-19-10-22(13-28)26(33)23(11-19)14-28/h3-8,16,19,22-24,26,33H,1-2,9-14,17H2,(H,31,34)