N-(1-adamantyl)-4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-(1-adamantyl)-4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: N-(1-adamantyl)-4-[5,6-dimethyl-2-(p-tolyl)pyrimidin-4-yl]piperazine-1-carboxamide CAS Name: N-(1-adamantyl)-4-[5,6-dimethyl-2-(4-methylphenyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: N-(1-adamantyl)-4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazine-1-carboxamide Traditional Name: N-(1-adamantyl)-4-[5,6-dimethyl-2-(p-tolyl)pyrimidin-4-yl]piperazine-1-carboxamide Formula: C28H37N5O MolecularWeight: 459.62628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NC45CC6CC(C4)CC(C6)C5)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)NC45CC6CC(C4)CC(C6)C5)C)C

InChI

InChI=1S/C28H37N5O/c1-18-4-6-24(7-5-18)25-29-20(3)19(2)26(30-25)32-8-10-33(11-9-32)27(34)31-28-15-21-12-22(16-28)14-23(13-21)17-28/h4-7,21-23H,8-17H2,1-3H3,(H,31,34)