N-methyl-N-[2-(4-phenylpiperidin-1-yl)pyrimidin-4-yl]adamantane-1-carboxamide

Systemtic Name: N-methyl-N-[2-(4-phenylpiperidin-1-yl)pyrimidin-4-yl]adamantane-1-carboxamide Openeye Name: N-methyl-N-[2-(4-phenyl-1-piperidyl)pyrimidin-4-yl]adamantane-1-carboxamide CAS Name: N-methyl-N-[2-(4-phenyl-1-piperidinyl)-4-pyrimidinyl]-1-adamantanecarboxamide IUPAC Name: N-methyl-N-[2-(4-phenylpiperidin-1-yl)pyrimidin-4-yl]adamantane-1-carboxamide Traditional Name: N-methyl-N-[2-(4-phenylpiperidino)pyrimidin-4-yl]adamantane-1-carboxamide Formula: C27H34N4O MolecularWeight: 430.58506

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=NC(=NC=C1)N2CCC(CC2)C3=CC=CC=C3)C(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CN(C1=NC(=NC=C1)N2CCC(CC2)C3=CC=CC=C3)C(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H34N4O/c1-30(25(32)27-16-19-13-20(17-27)15-21(14-19)18-27)24-7-10-28-26(29-24)31-11-8-23(9-12-31)22-5-3-2-4-6-22/h2-7,10,19-21,23H,8-9,11-18H2,1H3