5-[[ethyl(hexyl)amino]-methyl-amino]-N,N-dimethyl-1,2,4-dithiazolidin-4-ium-3-amine bromide

Systemtic Name: 5-[[ethyl(hexyl)amino]-methyl-amino]-N,N-dimethyl-1,2,4-dithiazolidin-4-ium-3-amine bromide Openeye Name: 5-[[ethyl(hexyl)amino]-methyl-amino]-N,N-dimethyl-1,2,4-dithiazolidin-4-ium-3-amine bromide CAS Name: 5-[[ethyl(hexyl)amino]-methylamino]-N,N-dimethyl-1,2,4-dithiazolidin-4-ium-3-amine bromide IUPAC Name: 5-[[ethyl(hexyl)amino]-methylamino]-N,N-dimethyl-1,2,4-dithiazolidin-4-ium-3-amine bromide Traditional Name: [5-[[ethyl(hexyl)amino]-methyl-amino]-1,2,4-dithiazolidin-4-ium-3-yl]-dimethyl-amine bromide Formula: C13H31BrN4S2 MolecularWeight: 387.44604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CC)N(C)C1[NH2+]C(SS1)N(C)C.[Br-]

Isomeric SMILES

CCCCCCN(CC)N(C)C1[NH2+]C(SS1)N(C)C.[Br-]

InChI

InChI=1S/C13H30N4S2.BrH/c1-6-8-9-10-11-17(7-2)16(5)13-14-12(15(3)4)18-19-13;/h12-14H,6-11H2,1-5H3;1H