1-[2-methyl-4-[6-(4-methylphenoxy)pyrimidin-4-yl]piperazin-1-yl]pentan-1-one

Systemtic Name: 1-[2-methyl-4-[6-(4-methylphenoxy)pyrimidin-4-yl]piperazin-1-yl]pentan-1-one Openeye Name: 1-[2-methyl-4-[6-(4-methylphenoxy)pyrimidin-4-yl]piperazin-1-yl]pentan-1-one CAS Name: 1-[2-methyl-4-[6-(4-methylphenoxy)-4-pyrimidinyl]-1-piperazinyl]-1-pentanone IUPAC Name: 1-[2-methyl-4-[6-(4-methylphenoxy)pyrimidin-4-yl]piperazin-1-yl]pentan-1-one Traditional Name: 1-[2-methyl-4-[6-(4-methylphenoxy)pyrimidin-4-yl]piperazino]pentan-1-one Formula: C21H28N4O2 MolecularWeight: 368.47262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N1CCN(CC1C)C2=CC(=NC=N2)OC3=CC=C(C=C3)C

Isomeric SMILES

CCCCC(=O)N1CCN(CC1C)C2=CC(=NC=N2)OC3=CC=C(C=C3)C

InChI

InChI=1S/C21H28N4O2/c1-4-5-6-21(26)25-12-11-24(14-17(25)3)19-13-20(23-15-22-19)27-18-9-7-16(2)8-10-18/h7-10,13,15,17H,4-6,11-12,14H2,1-3H3