2-[[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione

Systemtic Name: 2-[[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione Openeye Name: 2-[[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione CAS Name: 2-[[4-[5-(trifluoromethyl)-2-pyridinyl]-1,4-diazepan-1-yl]methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione IUPAC Name: 2-[[4-[5-(trifluoromethyl)pyridin-2-yl]-1,4-diazepan-1-yl]methyl]-2,4-diazaspiro[4.6]undecane-1,3-dione Traditional Name: 2-[[4-[5-(trifluoromethyl)-2-pyridyl]-1,4-diazepan-1-yl]methyl]-2,4-diazaspiro[4.6]undecane-1,3-quinone Formula: C21H28F3N5O2 MolecularWeight: 439.47453

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC2(CC1)C(=O)N(C(=O)N2)CN3CCCN(CC3)C4=NC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CCCC2(CC1)C(=O)N(C(=O)N2)CN3CCCN(CC3)C4=NC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C21H28F3N5O2/c22-21(23,24)16-6-7-17(25-14-16)28-11-5-10-27(12-13-28)15-29-18(30)20(26-19(29)31)8-3-1-2-4-9-20/h6-7,14H,1-5,8-13,15H2,(H,26,31)