1-(5-methyl-2-propan-2-yl-phenoxy)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol

Systemtic Name: 1-(5-methyl-2-propan-2-yl-phenoxy)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol Openeye Name: 1-(2-isopropyl-5-methyl-phenoxy)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol CAS Name: 1-(5-methyl-2-propan-2-ylphenoxy)-3-[4-(2-pyrimidinyl)-1-piperazinyl]-2-propanol IUPAC Name: 1-(5-methyl-2-propan-2-ylphenoxy)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-2-ol Traditional Name: 1-(2-isopropyl-5-methyl-phenoxy)-3-[4-(2-pyrimidyl)piperazino]propan-2-ol Formula: C21H30N4O2 MolecularWeight: 370.4885

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(CN2CCN(CC2)C3=NC=CC=N3)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(CN2CCN(CC2)C3=NC=CC=N3)O

InChI

InChI=1S/C21H30N4O2/c1-16(2)19-6-5-17(3)13-20(19)27-15-18(26)14-24-9-11-25(12-10-24)21-22-7-4-8-23-21/h4-8,13,16,18,26H,9-12,14-15H2,1-3H3