2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-(trifluoromethyl)phenyl]sulfonylpiperazino]sulfonylbenzonitrile Formula: C18H16F3N3O4S2 MolecularWeight: 459.46255

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1S(=O)(=O)C2=CC=CC=C2C#N)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CN(CCN1S(=O)(=O)C2=CC=CC=C2C#N)S(=O)(=O)C3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C18H16F3N3O4S2/c19-18(20,21)15-6-2-4-8-17(15)30(27,28)24-11-9-23(10-12-24)29(25,26)16-7-3-1-5-14(16)13-22/h1-8H,9-12H2