4-[4-[3-(trifluoromethyl)cyclohexyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[3-(trifluoromethyl)cyclohexyl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[3-(trifluoromethyl)cyclohexanecarbonyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[oxo-[3-(trifluoromethyl)cyclohexyl]methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[3-(trifluoromethyl)cyclohexanecarbonyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[3-(trifluoromethyl)cyclohexanecarbonyl]piperazino]sulfonylbenzonitrile Formula: C19H22F3N3O3S MolecularWeight: 429.45649

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)C(F)(F)F)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC(CC(C1)C(F)(F)F)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H22F3N3O3S/c20-19(21,22)16-3-1-2-15(12-16)18(26)24-8-10-25(11-9-24)29(27,28)17-6-4-14(13-23)5-7-17/h4-7,15-16H,1-3,8-12H2