4-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[4-(4-fluorophenyl)sulfonylpiperazino]-2-(trifluoromethyl)benzonitrile Formula: C18H15F4N3O2S MolecularWeight: 413.389213

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)C#N)C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)C#N)C(F)(F)F)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H15F4N3O2S/c19-14-2-5-16(6-3-14)28(26,27)25-9-7-24(8-10-25)15-4-1-13(12-23)17(11-15)18(20,21)22/h1-6,11H,7-10H2