2-[[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methyl]pentanedinitrile

Systemtic Name: 2-[[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methyl]pentanedinitrile Openeye Name: 2-[[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methyl]pentanedinitrile CAS Name: 2-[[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]methyl]pentanedinitrile IUPAC Name: 2-[[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methyl]pentanedinitrile Traditional Name: 2-[[4-(2-fluorophenyl)sulfonylpiperazino]methyl]glutaronitrile Formula: C16H19FN4O2S MolecularWeight: 350.411063

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CCC#N)C#N)S(=O)(=O)C2=CC=CC=C2F

Isomeric SMILES

C1CN(CCN1CC(CCC#N)C#N)S(=O)(=O)C2=CC=CC=C2F

InChI

InChI=1S/C16H19FN4O2S/c17-15-5-1-2-6-16(15)24(22,23)21-10-8-20(9-11-21)13-14(12-19)4-3-7-18/h1-2,5-6,14H,3-4,8-11,13H2