4-[4-[(4-cyclobutyl-1,4-diazepan-1-yl)carbonyl]piperidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[4-[(4-cyclobutyl-1,4-diazepan-1-yl)carbonyl]piperidin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[4-(4-cyclobutyl-1,4-diazepane-1-carbonyl)-1-piperidyl]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[4-[(4-cyclobutyl-1,4-diazepan-1-yl)-oxomethyl]-1-piperidinyl]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[4-(4-cyclobutyl-1,4-diazepane-1-carbonyl)piperidin-1-yl]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[4-(4-cyclobutyl-1,4-diazepane-1-carbonyl)piperidino]-2-(trifluoromethyl)benzonitrile Formula: C23H29F3N4O MolecularWeight: 434.49777

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)N2CCCN(CC2)C(=O)C3CCN(CC3)C4=CC(=C(C=C4)C#N)C(F)(F)F

Isomeric SMILES

C1CC(C1)N2CCCN(CC2)C(=O)C3CCN(CC3)C4=CC(=C(C=C4)C#N)C(F)(F)F

InChI

InChI=1S/C23H29F3N4O/c24-23(25,26)21-15-20(6-5-18(21)16-27)29-11-7-17(8-12-29)22(31)30-10-2-9-28(13-14-30)19-3-1-4-19/h5-6,15,17,19H,1-4,7-14H2