1-adamantyl-[4-[6-methyl-2-(4-methylphenyl)-5-propan-2-yl-pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-[6-methyl-2-(4-methylphenyl)-5-propan-2-yl-pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-[5-isopropyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-[6-methyl-2-(4-methylphenyl)-5-propan-2-yl-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-[6-methyl-2-(4-methylphenyl)-5-propan-2-ylpyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-[5-isopropyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazino]methanone Formula: C30H40N4O MolecularWeight: 472.6648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)C45CC6CC(C4)CC(C6)C5)C(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)C45CC6CC(C4)CC(C6)C5)C(C)C)C

InChI

InChI=1S/C30H40N4O/c1-19(2)26-21(4)31-27(25-7-5-20(3)6-8-25)32-28(26)33-9-11-34(12-10-33)29(35)30-16-22-13-23(17-30)15-24(14-22)18-30/h5-8,19,22-24H,9-18H2,1-4H3