disodium 3-azanyl-4-[(2-azanyl-4-sulfonato-butyl)disulfanyl]butane-1-sulfonate dihydrochloride

Systemtic Name: disodium 3-azanyl-4-[(2-azanyl-4-sulfonato-butyl)disulfanyl]butane-1-sulfonate dihydrochloride Openeye Name: disodium 3-amino-4-[(2-amino-4-sulfonato-butyl)disulfanyl]butane-1-sulfonate dihydrochloride CAS Name: disodium 3-amino-4-[(2-amino-4-sulfonatobutyl)disulfanyl]-1-butanesulfonate dihydrochloride IUPAC Name: disodium 3-amino-4-[(2-amino-4-sulfonatobutyl)disulfanyl]butane-1-sulfonate dihydrochloride Traditional Name: disodium 3-amino-4-[(2-amino-4-sulfonato-butyl)disulfanyl]butane-1-sulfonate dihydrochloride Formula: C8H20Cl2N2Na2O6S4 MolecularWeight: 485.39974

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Descriptors Computed from Structure

Canonical SMILES:

C(CS(=O)(=O)[O-])C(CSSCC(CCS(=O)(=O)[O-])N)N.[Na+].[Na+].Cl.Cl

Isomeric SMILES

C(CS(=O)(=O)[O-])C(CSSCC(CCS(=O)(=O)[O-])N)N.[Na+].[Na+].Cl.Cl

InChI

InChI=1S/C8H20N2O6S4.2ClH.2Na/c9-7(1-3-19(11,12)13)5-17-18-6-8(10)2-4-20(14,15)16;;;;/h7-8H,1-6,9-10H2,(H,11,12,13)(H,14,15,16);2*1H;;/q;;;2*+1/p-2