6-[4-[2-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 6-[4-[2-(trifluoromethyloxy)phenyl]sulfonylpiperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 6-[4-[2-(trifluoromethoxy)phenyl]sulfonylpiperazin-1-yl]pyridine-3-carbonitrile CAS Name: 6-[4-[2-(trifluoromethoxy)phenyl]sulfonyl-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 6-[4-[2-(trifluoromethoxy)phenyl]sulfonylpiperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 6-[4-[2-(trifluoromethoxy)phenyl]sulfonylpiperazino]nicotinonitrile Formula: C17H15F3N4O3S MolecularWeight: 412.38621

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC=C3OC(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C#N)S(=O)(=O)C3=CC=CC=C3OC(F)(F)F

InChI

InChI=1S/C17H15F3N4O3S/c18-17(19,20)27-14-3-1-2-4-15(14)28(25,26)24-9-7-23(8-10-24)16-6-5-13(11-21)12-22-16/h1-6,12H,7-10H2