1-[4-(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]-2-phenoxy-propan-1-one

Systemtic Name: 1-[4-(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)piperazin-1-yl]-2-phenoxy-propan-1-one Openeye Name: 1-[4-[4-methyl-6-(1-piperidyl)pyrimidin-2-yl]piperazin-1-yl]-2-phenoxy-propan-1-one CAS Name: 1-[4-[4-methyl-6-(1-piperidinyl)-2-pyrimidinyl]-1-piperazinyl]-2-phenoxy-1-propanone IUPAC Name: 1-[4-(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)piperazin-1-yl]-2-phenoxypropan-1-one Traditional Name: 1-[4-(4-methyl-6-piperidino-pyrimidin-2-yl)piperazino]-2-phenoxy-propan-1-one Formula: C23H31N5O2 MolecularWeight: 409.52454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)C(C)OC3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCN(CC2)C(=O)C(C)OC3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C23H31N5O2/c1-18-17-21(26-11-7-4-8-12-26)25-23(24-18)28-15-13-27(14-16-28)22(29)19(2)30-20-9-5-3-6-10-20/h3,5-6,9-10,17,19H,4,7-8,11-16H2,1-2H3