1-[4-[2-oxidanyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propoxy]phenoxy]-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol

Systemtic Name: 1-[4-[2-oxidanyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propoxy]phenoxy]-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol Openeye Name: 1-[4-[2-hydroxy-3-(4-pyrimidin-2-ylpiperazin-1-yl)propoxy]phenoxy]-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol CAS Name: 1-[4-[2-hydroxy-3-[4-(2-pyrimidinyl)-1-piperazinyl]propoxy]phenoxy]-3-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-[4-[2-hydroxy-3-(4-pyrimidin-2-ylpiperazin-1-yl)propoxy]phenoxy]-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol Traditional Name: 1-[4-[2-hydroxy-3-[4-(2-pyrimidyl)piperazino]propoxy]phenoxy]-3-[4-(2-pyrimidyl)piperazino]propan-2-ol Formula: C28H38N8O4 MolecularWeight: 550.65252

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC2=CC=C(C=C2)OCC(CN3CCN(CC3)C4=NC=CC=N4)O)O)C5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1CC(COC2=CC=C(C=C2)OCC(CN3CCN(CC3)C4=NC=CC=N4)O)O)C5=NC=CC=N5

InChI

InChI=1S/C28H38N8O4/c37-23(19-33-11-15-35(16-12-33)27-29-7-1-8-30-27)21-39-25-3-5-26(6-4-25)40-22-24(38)20-34-13-17-36(18-14-34)28-31-9-2-10-32-28/h1-10,23-24,37-38H,11-22H2