2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-(4-fluorophenyl)-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(4-fluorophenyl)piperazino]sulfonylbenzonitrile Formula: C17H16FN3O2S MolecularWeight: 345.391243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16FN3O2S/c18-15-5-7-16(8-6-15)20-9-11-21(12-10-20)24(22,23)17-4-2-1-3-14(17)13-19/h1-8H,9-12H2