3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]sulfonylbenzonitrile CAS Name: 3-[[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 3-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[4-(3-fluorophenyl)sulfonylpiperazino]sulfonylbenzonitrile Formula: C17H16FN3O4S2 MolecularWeight: 409.455043

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16FN3O4S2/c18-15-4-2-6-17(12-15)27(24,25)21-9-7-20(8-10-21)26(22,23)16-5-1-3-14(11-16)13-19/h1-6,11-12H,7-10H2