1-[4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]nonan-1-one

Systemtic Name: 1-[4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]nonan-1-one Openeye Name: 1-[4-[5,6-dimethyl-2-(p-tolyl)pyrimidin-4-yl]piperazin-1-yl]nonan-1-one CAS Name: 1-[4-[5,6-dimethyl-2-(4-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]-1-nonanone IUPAC Name: 1-[4-[5,6-dimethyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]nonan-1-one Traditional Name: 1-[4-[5,6-dimethyl-2-(p-tolyl)pyrimidin-4-yl]piperazino]nonan-1-one Formula: C26H38N4O MolecularWeight: 422.60612

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H38N4O/c1-5-6-7-8-9-10-11-24(31)29-16-18-30(19-17-29)26-21(3)22(4)27-25(28-26)23-14-12-20(2)13-15-23/h12-15H,5-11,16-19H2,1-4H3