4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,5-dimethyl-piperazine-1-sulfonamide

Systemtic Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,5-dimethyl-piperazine-1-sulfonamide Openeye Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,5-dimethyl-piperazine-1-sulfonamide CAS Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,5-dimethyl-1-piperazinesulfonamide IUPAC Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,5-dimethylpiperazine-1-sulfonamide Traditional Name: 4-[4-cyano-3-(trifluoromethyl)phenyl]-N-(4-fluorophenyl)-2,5-dimethyl-piperazine-1-sulfonamide Formula: C20H20F4N4O2S MolecularWeight: 456.457013

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1S(=O)(=O)NC2=CC=C(C=C2)F)C)C3=CC(=C(C=C3)C#N)C(F)(F)F

Isomeric SMILES

CC1CN(C(CN1S(=O)(=O)NC2=CC=C(C=C2)F)C)C3=CC(=C(C=C3)C#N)C(F)(F)F

InChI

InChI=1S/C20H20F4N4O2S/c1-13-12-28(31(29,30)26-17-6-4-16(21)5-7-17)14(2)11-27(13)18-8-3-15(10-25)19(9-18)20(22,23)24/h3-9,13-14,26H,11-12H2,1-2H3