N-[3-(4-fluorophenyl)sulfanylpropyl]-1-(phenylsulfonyl)cyclopentane-1-carboxamide

Systemtic Name: N-[3-(4-fluorophenyl)sulfanylpropyl]-1-(phenylsulfonyl)cyclopentane-1-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-[3-(4-fluorophenyl)sulfanylpropyl]cyclopentanecarboxamide CAS Name: 1-(benzenesulfonyl)-N-[3-[(4-fluorophenyl)thio]propyl]-1-cyclopentanecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-[3-(4-fluorophenyl)sulfanylpropyl]cyclopentane-1-carboxamide Traditional Name: 1-besyl-N-[3-[(4-fluorophenyl)thio]propyl]cyclopentanecarboxamide Formula: C21H24FNO3S2 MolecularWeight: 421.548563

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)(C(=O)NCCCSC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC(C1)(C(=O)NCCCSC2=CC=C(C=C2)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24FNO3S2/c22-17-9-11-18(12-10-17)27-16-6-15-23-20(24)21(13-4-5-14-21)28(25,26)19-7-2-1-3-8-19/h1-3,7-12H,4-6,13-16H2,(H,23,24)