N-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-fluoranyl-benzenesulfonamide

Systemtic Name: N-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-2-fluoranyl-benzenesulfonamide Openeye Name: N-[(1S)-1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-methylsulfanyl-propyl]-2-fluoro-benzenesulfonamide CAS Name: N-[(2S)-1-[4-(3-chlorophenyl)-1-piperazinyl]-4-(methylthio)-1-oxobutan-2-yl]-2-fluorobenzenesulfonamide IUPAC Name: N-[(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-4-methylsulfanyl-1-oxobutan-2-yl]-2-fluorobenzenesulfonamide Traditional Name: N-[(1S)-1-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-(methylthio)propyl]-2-fluoro-benzenesulfonamide Formula: C21H25ClFN3O3S2 MolecularWeight: 486.022903

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)NS(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CSCC[C@@H](C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl)NS(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C21H25ClFN3O3S2/c1-30-14-9-19(24-31(28,29)20-8-3-2-7-18(20)23)21(27)26-12-10-25(11-13-26)17-6-4-5-16(22)15-17/h2-8,15,19,24H,9-14H2,1H3/t19-/m0/s1