4-fluoranyl-3-[(4-thiophen-2-ylsulfonylpiperazin-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-fluoranyl-3-[(4-thiophen-2-ylsulfonylpiperazin-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-fluoro-3-[[4-(2-thienylsulfonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-fluoro-3-[(4-thiophen-2-ylsulfonyl-1-piperazinyl)methyl]benzonitrile IUPAC Name: 4-fluoro-3-[(4-thiophen-2-ylsulfonylpiperazin-1-yl)methyl]benzonitrile Traditional Name: 4-fluoro-3-[[4-(2-thienylsulfonyl)piperazino]methyl]benzonitrile Formula: C16H16FN3O2S2 MolecularWeight: 365.445543

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC(=C2)C#N)F)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC(=C2)C#N)F)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C16H16FN3O2S2/c17-15-4-3-13(11-18)10-14(15)12-19-5-7-20(8-6-19)24(21,22)16-2-1-9-23-16/h1-4,9-10H,5-8,12H2