piperidin-1-yl-[3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]methanone

Systemtic Name: piperidin-1-yl-[3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]methanone Openeye Name: 1-piperidyl-[3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]methanone CAS Name: 1-piperidinyl-[3-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]phenyl]methanone IUPAC Name: piperidin-1-yl-[3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]phenyl]methanone Traditional Name: piperidino-[3-[[4-(2-pyrimidyl)piperazino]methyl]phenyl]methanone Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC(=CC=C2)CN3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC(=CC=C2)CN3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H27N5O/c27-20(25-10-2-1-3-11-25)19-7-4-6-18(16-19)17-24-12-14-26(15-13-24)21-22-8-5-9-23-21/h4-9,16H,1-3,10-15,17H2