4-fluoranyl-N-[1-[2-(phenylmethylsulfanyl)propanoyl]piperidin-4-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[1-[2-(phenylmethylsulfanyl)propanoyl]piperidin-4-yl]benzenesulfonamide Openeye Name: N-[1-(2-benzylsulfanylpropanoyl)-4-piperidyl]-4-fluoro-benzenesulfonamide CAS Name: 4-fluoro-N-[1-[1-oxo-2-(phenylmethylthio)propyl]-4-piperidinyl]benzenesulfonamide IUPAC Name: N-[1-(2-benzylsulfanylpropanoyl)piperidin-4-yl]-4-fluorobenzenesulfonamide Traditional Name: N-[1-[2-(benzylthio)propanoyl]-4-piperidyl]-4-fluoro-benzenesulfonamide Formula: C21H25FN2O3S2 MolecularWeight: 436.563203

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)F)SCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)F)SCC3=CC=CC=C3

InChI

InChI=1S/C21H25FN2O3S2/c1-16(28-15-17-5-3-2-4-6-17)21(25)24-13-11-19(12-14-24)23-29(26,27)20-9-7-18(22)8-10-20/h2-10,16,19,23H,11-15H2,1H3