4-methylsulfanyl-N-(3-morpholin-4-ium-4-ylpropyl)benzenesulfonamide

Systemtic Name: 4-methylsulfanyl-N-(3-morpholin-4-ium-4-ylpropyl)benzenesulfonamide Openeye Name: 4-methylsulfanyl-N-(3-morpholin-4-ium-4-ylpropyl)benzenesulfonamide CAS Name: 4-(methylthio)-N-[3-(4-morpholin-4-iumyl)propyl]benzenesulfonamide IUPAC Name: 4-methylsulfanyl-N-(3-morpholin-4-ium-4-ylpropyl)benzenesulfonamide Traditional Name: 4-(methylthio)-N-(3-morpholin-4-ium-4-ylpropyl)benzenesulfonamide Formula: C14H23N2O3S2+ MolecularWeight: 331.47402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)S(=O)(=O)NCCC[NH+]2CCOCC2

Isomeric SMILES

CSC1=CC=C(C=C1)S(=O)(=O)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C14H22N2O3S2/c1-20-13-3-5-14(6-4-13)21(17,18)15-7-2-8-16-9-11-19-12-10-16/h3-6,15H,2,7-12H2,1H3/p+1