3-chloranyl-N-[1-(4-ethanoylpiperazin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[1-(4-ethanoylpiperazin-1-yl)-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[1-(4-acetylpiperazine-1-carbonyl)-3-methylsulfanyl-propyl]-3-chloro-4-fluoro-benzenesulfonamide CAS Name: N-[1-(4-acetyl-1-piperazinyl)-4-(methylthio)-1-oxobutan-2-yl]-3-chloro-4-fluorobenzenesulfonamide IUPAC Name: N-[1-(4-acetylpiperazin-1-yl)-4-methylsulfanyl-1-oxobutan-2-yl]-3-chloro-4-fluorobenzenesulfonamide Traditional Name: N-[1-(4-acetylpiperazine-1-carbonyl)-3-(methylthio)propyl]-3-chloro-4-fluoro-benzenesulfonamide Formula: C17H23ClFN3O4S2 MolecularWeight: 451.963623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C(CCSC)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C(CCSC)NS(=O)(=O)C2=CC(=C(C=C2)F)Cl

InChI

InChI=1S/C17H23ClFN3O4S2/c1-12(23)21-6-8-22(9-7-21)17(24)16(5-10-27-2)20-28(25,26)13-3-4-15(19)14(18)11-13/h3-4,11,16,20H,5-10H2,1-2H3