2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[5-(trifluoromethyl)-2-pyridyl]piperazino]sulfonylbenzonitrile Formula: C17H15F3N4O2S MolecularWeight: 396.38681

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)S(=O)(=O)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2)C(F)(F)F)S(=O)(=O)C3=CC=CC=C3C#N

InChI

InChI=1S/C17H15F3N4O2S/c18-17(19,20)14-5-6-16(22-12-14)23-7-9-24(10-8-23)27(25,26)15-4-2-1-3-13(15)11-21/h1-6,12H,7-10H2