1-[4-[6-methyl-2-(3-methylphenyl)-5-propan-2-yl-pyrimidin-4-yl]piperazin-1-yl]butan-1-one

Systemtic Name: 1-[4-[6-methyl-2-(3-methylphenyl)-5-propan-2-yl-pyrimidin-4-yl]piperazin-1-yl]butan-1-one Openeye Name: 1-[4-[5-isopropyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]butan-1-one CAS Name: 1-[4-[6-methyl-2-(3-methylphenyl)-5-propan-2-yl-4-pyrimidinyl]-1-piperazinyl]-1-butanone IUPAC Name: 1-[4-[6-methyl-2-(3-methylphenyl)-5-propan-2-ylpyrimidin-4-yl]piperazin-1-yl]butan-1-one Traditional Name: 1-[4-[5-isopropyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]butan-1-one Formula: C23H32N4O MolecularWeight: 380.52638

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=NC(=NC(=C2C(C)C)C)C3=CC(=CC=C3)C

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=NC(=NC(=C2C(C)C)C)C3=CC(=CC=C3)C

InChI

InChI=1S/C23H32N4O/c1-6-8-20(28)26-11-13-27(14-12-26)23-21(16(2)3)18(5)24-22(25-23)19-10-7-9-17(4)15-19/h7,9-10,15-16H,6,8,11-14H2,1-5H3