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

Systemtic Name: 1-adamantyl-[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-(2,6-dimethyl-5-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-(2,6-dimethyl-5-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)piperazino]methanone Formula: C24H36N4O MolecularWeight: 396.56884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)C(C)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)C(C)C

InChI

InChI=1S/C24H36N4O/c1-15(2)21-16(3)25-17(4)26-22(21)27-5-7-28(8-6-27)23(29)24-12-18-9-19(13-24)11-20(10-18)14-24/h15,18-20H,5-14H2,1-4H3