[azanyl-[4-methyl-4-oxidanyl-1,1-bis(oxidanylidene)thiolan-3-yl]sulfanyl-methylidene]azanium sulfate

Systemtic Name: [azanyl-[4-methyl-4-oxidanyl-1,1-bis(oxidanylidene)thiolan-3-yl]sulfanyl-methylidene]azanium sulfate Openeye Name: [amino-(4-hydroxy-4-methyl-1,1-dioxo-thiolan-3-yl)sulfanyl-methylene]ammonium sulfate CAS Name: [amino-[(4-hydroxy-4-methyl-1,1-dioxo-3-thiolanyl)thio]methylidene]ammonium sulfate IUPAC Name: [amino-(4-hydroxy-4-methyl-1,1-dioxothiolan-3-yl)sulfanylmethylidene]azanium sulfate Traditional Name: [amino-[(4-hydroxy-1,1-diketo-4-methyl-thiolan-3-yl)thio]methylene]ammonium sulfate Formula: C12H26N4O10S5 MolecularWeight: 546.68064

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CS(=O)(=O)CC1SC(=[NH2+])N)O.CC1(CS(=O)(=O)CC1SC(=[NH2+])N)O.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CC1(CS(=O)(=O)CC1SC(=[NH2+])N)O.CC1(CS(=O)(=O)CC1SC(=[NH2+])N)O.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C6H12N2O3S2.H2O4S/c2*1-6(9)3-13(10,11)2-4(6)12-5(7)8;1-5(2,3)4/h2*4,9H,2-3H2,1H3,(H3,7,8);(H2,1,2,3,4)