(3-methylcyclohexyl)-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]methanone

Systemtic Name: (3-methylcyclohexyl)-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]methanone Openeye Name: (3-methylcyclohexyl)-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]methanone CAS Name: (3-methylcyclohexyl)-[4-[4-(3-methylphenoxy)-2-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (3-methylcyclohexyl)-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]methanone Traditional Name: (3-methylcyclohexyl)-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazino]methanone Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)C(=O)N2CCN(CC2)C3=NC=CC(=N3)OC4=CC=CC(=C4)C

Isomeric SMILES

CC1CCCC(C1)C(=O)N2CCN(CC2)C3=NC=CC(=N3)OC4=CC=CC(=C4)C

InChI

InChI=1S/C23H30N4O2/c1-17-5-3-7-19(15-17)22(28)26-11-13-27(14-12-26)23-24-10-9-21(25-23)29-20-8-4-6-18(2)16-20/h4,6,8-10,16-17,19H,3,5,7,11-15H2,1-2H3