N-[1-[(5-cyano-2-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-[(5-cyano-2-fluoranyl-phenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-[(5-cyano-2-fluoro-phenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-sulfonamide CAS Name: N-[1-[(5-cyano-2-fluorophenyl)methyl]-4-piperidin-1-iumyl]-2-thiophenesulfonamide IUPAC Name: N-[1-[(5-cyano-2-fluorophenyl)methyl]piperidin-1-ium-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-(5-cyano-2-fluoro-benzyl)piperidin-1-ium-4-yl]thiophene-2-sulfonamide Formula: C17H19FN3O2S2+ MolecularWeight: 380.480063

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NS(=O)(=O)C2=CC=CS2)CC3=C(C=CC(=C3)C#N)F

Isomeric SMILES

C1C[NH+](CCC1NS(=O)(=O)C2=CC=CS2)CC3=C(C=CC(=C3)C#N)F

InChI

InChI=1S/C17H18FN3O2S2/c18-16-4-3-13(11-19)10-14(16)12-21-7-5-15(6-8-21)20-25(22,23)17-2-1-9-24-17/h1-4,9-10,15,20H,5-8,12H2/p+1