1-butoxy-3-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]propan-2-ol

Systemtic Name: 1-butoxy-3-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]propan-2-ol Openeye Name: 1-butoxy-3-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]propan-2-ol CAS Name: 1-butoxy-3-[4-[4-(trifluoromethyl)-2-pyrimidinyl]-1,4-diazepan-1-yl]-2-propanol IUPAC Name: 1-butoxy-3-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]propan-2-ol Traditional Name: 1-butoxy-3-[4-[4-(trifluoromethyl)pyrimidin-2-yl]-1,4-diazepan-1-yl]propan-2-ol Formula: C17H27F3N4O2 MolecularWeight: 376.41709

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(CN1CCCN(CC1)C2=NC=CC(=N2)C(F)(F)F)O

Isomeric SMILES

CCCCOCC(CN1CCCN(CC1)C2=NC=CC(=N2)C(F)(F)F)O

InChI

InChI=1S/C17H27F3N4O2/c1-2-3-11-26-13-14(25)12-23-7-4-8-24(10-9-23)16-21-6-5-15(22-16)17(18,19)20/h5-6,14,25H,2-4,7-13H2,1H3