dimethyl-[[4-[(2-morpholin-4-ium-4-ylethylcarbamothioylamino)methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[(2-morpholin-4-ium-4-ylethylcarbamothioylamino)methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[4-[(2-morpholin-4-ium-4-ylethylcarbamothioylamino)methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[4-[[[[2-(4-morpholin-4-iumyl)ethylamino]-sulfanylidenemethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[(2-morpholin-4-ium-4-ylethylcarbamothioylamino)methyl]phenyl]methyl]azanium Traditional Name: dimethyl-[4-[(2-morpholin-4-ium-4-ylethylthiocarbamoylamino)methyl]benzyl]ammonium Formula: C17H30N4OS+2 MolecularWeight: 338.5113

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=S)NCC[NH+]2CCOCC2

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=S)NCC[NH+]2CCOCC2

InChI

InChI=1S/C17H28N4OS/c1-20(2)14-16-5-3-15(4-6-16)13-19-17(23)18-7-8-21-9-11-22-12-10-21/h3-6H,7-14H2,1-2H3,(H2,18,19,23)/p+2