4-(cyclohexylmethyl)-1-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-5-one

Systemtic Name: 4-(cyclohexylmethyl)-1-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-5-one Openeye Name: 4-(cyclohexylmethyl)-1-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-5-one CAS Name: 4-(cyclohexylmethyl)-1-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-5-one IUPAC Name: 4-(cyclohexylmethyl)-1-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-5-one Traditional Name: 4-(cyclohexylmethyl)-1-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-5-one Formula: C18H24F3N3O MolecularWeight: 355.39787

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2CCN(CCC2=O)C3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CCC(CC1)CN2CCN(CCC2=O)C3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C18H24F3N3O/c19-18(20,21)15-6-7-16(22-12-15)23-9-8-17(25)24(11-10-23)13-14-4-2-1-3-5-14/h6-7,12,14H,1-5,8-11,13H2