2-[4-[[3-(4-phenylpiperazin-1-yl)piperidin-1-yl]methyl]phenoxy]pyrimidine

Systemtic Name: 2-[4-[[3-(4-phenylpiperazin-1-yl)piperidin-1-yl]methyl]phenoxy]pyrimidine Openeye Name: 2-[4-[[3-(4-phenylpiperazin-1-yl)-1-piperidyl]methyl]phenoxy]pyrimidine CAS Name: 2-[4-[[3-(4-phenyl-1-piperazinyl)-1-piperidinyl]methyl]phenoxy]pyrimidine IUPAC Name: 2-[4-[[3-(4-phenylpiperazin-1-yl)piperidin-1-yl]methyl]phenoxy]pyrimidine Traditional Name: 2-[4-[[3-(4-phenylpiperazino)piperidino]methyl]phenoxy]pyrimidine Formula: C26H31N5O MolecularWeight: 429.55724

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=C(C=C2)OC3=NC=CC=N3)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CC(CN(C1)CC2=CC=C(C=C2)OC3=NC=CC=N3)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C26H31N5O/c1-2-6-23(7-3-1)30-16-18-31(19-17-30)24-8-4-15-29(21-24)20-22-9-11-25(12-10-22)32-26-27-13-5-14-28-26/h1-3,5-7,9-14,24H,4,8,15-21H2