5-(2-hexyl-1,2-diazinan-1-yl)-N,N-dimethyl-1,2,4-dithiazolidin-4-ium-3-amine iodide

Systemtic Name: 5-(2-hexyl-1,2-diazinan-1-yl)-N,N-dimethyl-1,2,4-dithiazolidin-4-ium-3-amine iodide Openeye Name: 5-(2-hexylhexahydropyridazin-1-yl)-N,N-dimethyl-1,2,4-dithiazolidin-4-ium-3-amine iodide CAS Name: 5-(2-hexyl-1-diazinanyl)-N,N-dimethyl-1,2,4-dithiazolidin-4-ium-3-amine iodide IUPAC Name: 5-(2-hexyldiazinan-1-yl)-N,N-dimethyl-1,2,4-dithiazolidin-4-ium-3-amine iodide Traditional Name: [5-(2-hexylhexahydropyridazin-1-yl)-1,2,4-dithiazolidin-4-ium-3-yl]-dimethyl-amine iodide Formula: C14H31IN4S2 MolecularWeight: 446.45721

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCCCN1C2[NH2+]C(SS2)N(C)C.[I-]

Isomeric SMILES

CCCCCCN1CCCCN1C2[NH2+]C(SS2)N(C)C.[I-]

InChI

InChI=1S/C14H30N4S2.HI/c1-4-5-6-7-10-17-11-8-9-12-18(17)14-15-13(16(2)3)19-20-14;/h13-15H,4-12H2,1-3H3;1H