1-phenoxy-1-pyridin-3-yl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol

Systemtic Name: 1-phenoxy-1-pyridin-3-yl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol Openeye Name: 1-phenoxy-1-(3-pyridyl)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol CAS Name: 1-phenoxy-1-(3-pyridinyl)-3-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-phenoxy-1-pyridin-3-yl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol Traditional Name: 1-phenoxy-1-(3-pyridyl)-3-[4-(2-pyrimidyl)piperazino]propan-2-ol Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(C(C2=CN=CC=C2)OC3=CC=CC=C3)O)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CC(C(C2=CN=CC=C2)OC3=CC=CC=C3)O)C4=NC=CC=N4

InChI

InChI=1S/C22H25N5O2/c28-20(17-26-12-14-27(15-13-26)22-24-10-5-11-25-22)21(18-6-4-9-23-16-18)29-19-7-2-1-3-8-19/h1-11,16,20-21,28H,12-15,17H2