4-[[4-[2-oxidanylidene-2-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]cyclohexyl]amino]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[[4-[2-oxidanylidene-2-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]cyclohexyl]amino]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[[4-[2-oxo-2-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]cyclohexyl]amino]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[[4-[2-oxo-2-[4-[4-(trifluoromethyl)phenyl]-1-piperazinyl]ethoxy]cyclohexyl]amino]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[[4-[2-oxo-2-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]ethoxy]cyclohexyl]amino]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[[4-[2-keto-2-[4-[4-(trifluoromethyl)phenyl]piperazino]ethoxy]cyclohexyl]amino]-2-(trifluoromethyl)benzonitrile Formula: C27H28F6N4O2 MolecularWeight: 554.527239

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=CC(=C(C=C2)C#N)C(F)(F)F)OCC(=O)N3CCN(CC3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CC(CCC1NC2=CC(=C(C=C2)C#N)C(F)(F)F)OCC(=O)N3CCN(CC3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C27H28F6N4O2/c28-26(29,30)19-2-7-22(8-3-19)36-11-13-37(14-12-36)25(38)17-39-23-9-5-20(6-10-23)35-21-4-1-18(16-34)24(15-21)27(31,32)33/h1-4,7-8,15,20,23,35H,5-6,9-14,17H2