dimethyl-[2-[[4-(phenylsulfonyl)piperazin-1-yl]carbothioylamino]ethyl]azanium

Systemtic Name: dimethyl-[2-[[4-(phenylsulfonyl)piperazin-1-yl]carbothioylamino]ethyl]azanium Openeye Name: 2-[[4-(benzenesulfonyl)piperazine-1-carbothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[4-(benzenesulfonyl)-1-piperazinyl]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[4-(benzenesulfonyl)piperazine-1-carbothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[(4-besylpiperazine-1-carbothioyl)amino]ethyl-dimethyl-ammonium Formula: C15H25N4O2S2+ MolecularWeight: 357.5146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)CCNC(=S)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H24N4O2S2/c1-17(2)9-8-16-15(22)18-10-12-19(13-11-18)23(20,21)14-6-4-3-5-7-14/h3-7H,8-13H2,1-2H3,(H,16,22)/p+1