N,N-dimethyl-5-(2,4,5-trimethylpiperazin-1-yl)-1,2,4-dithiazolidin-4-ium-3-amine ethanoate

Systemtic Name: N,N-dimethyl-5-(2,4,5-trimethylpiperazin-1-yl)-1,2,4-dithiazolidin-4-ium-3-amine ethanoate Openeye Name: N,N-dimethyl-5-(2,4,5-trimethylpiperazin-1-yl)-1,2,4-dithiazolidin-4-ium-3-amine acetate CAS Name: N,N-dimethyl-5-(2,4,5-trimethyl-1-piperazinyl)-1,2,4-dithiazolidin-4-ium-3-amine acetate IUPAC Name: N,N-dimethyl-5-(2,4,5-trimethylpiperazin-1-yl)-1,2,4-dithiazolidin-4-ium-3-amine acetate Traditional Name: dimethyl-[5-(2,4,5-trimethylpiperazino)-1,2,4-dithiazolidin-4-ium-3-yl]amine acetate Formula: C13H28N4O2S2 MolecularWeight: 336.51702

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C(CN1C2[NH2+]C(SS2)N(C)C)C)C.CC(=O)[O-]

Isomeric SMILES

CC1CN(C(CN1C2[NH2+]C(SS2)N(C)C)C)C.CC(=O)[O-]

InChI

InChI=1S/C11H24N4S2.C2H4O2/c1-8-7-15(9(2)6-14(8)5)11-12-10(13(3)4)16-17-11;1-2(3)4/h8-12H,6-7H2,1-5H3;1H3,(H,3,4)