1-(3-methylphenoxy)-3-[4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]piperazin-1-yl]propan-2-ol

Systemtic Name: 1-(3-methylphenoxy)-3-[4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]piperazin-1-yl]propan-2-ol Openeye Name: 1-(3-methylphenoxy)-3-[4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]piperazin-1-yl]propan-2-ol CAS Name: 1-(3-methylphenoxy)-3-[4-[[2-(1-pyrrolidinyl)-4-pyrimidinyl]methyl]-1-piperazinyl]-2-propanol IUPAC Name: 1-(3-methylphenoxy)-3-[4-[(2-pyrrolidin-1-ylpyrimidin-4-yl)methyl]piperazin-1-yl]propan-2-ol Traditional Name: 1-(3-methylphenoxy)-3-[4-[(2-pyrrolidinopyrimidin-4-yl)methyl]piperazino]propan-2-ol Formula: C23H33N5O2 MolecularWeight: 411.54042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(CN2CCN(CC2)CC3=NC(=NC=C3)N4CCCC4)O

Isomeric SMILES

CC1=CC(=CC=C1)OCC(CN2CCN(CC2)CC3=NC(=NC=C3)N4CCCC4)O

InChI

InChI=1S/C23H33N5O2/c1-19-5-4-6-22(15-19)30-18-21(29)17-27-13-11-26(12-14-27)16-20-7-8-24-23(25-20)28-9-2-3-10-28/h4-8,15,21,29H,2-3,9-14,16-18H2,1H3