4-fluoranyl-N-[1-[(5-nitro-1-benzothiophen-2-yl)carbonyl]piperidin-4-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[1-[(5-nitro-1-benzothiophen-2-yl)carbonyl]piperidin-4-yl]benzenesulfonamide Openeye Name: 4-fluoro-N-[1-(5-nitrobenzothiophene-2-carbonyl)-4-piperidyl]benzenesulfonamide CAS Name: 4-fluoro-N-[1-[(5-nitro-1-benzothiophen-2-yl)-oxomethyl]-4-piperidinyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[1-(5-nitro-1-benzothiophene-2-carbonyl)piperidin-4-yl]benzenesulfonamide Traditional Name: 4-fluoro-N-[1-(5-nitrobenzothiophene-2-carbonyl)-4-piperidyl]benzenesulfonamide Formula: C20H18FN3O5S2 MolecularWeight: 463.502423

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NS(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1NS(=O)(=O)C2=CC=C(C=C2)F)C(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H18FN3O5S2/c21-14-1-4-17(5-2-14)31(28,29)22-15-7-9-23(10-8-15)20(25)19-12-13-11-16(24(26)27)3-6-18(13)30-19/h1-6,11-12,15,22H,7-10H2