4-azanyl-3-methyl-5-oxidanylidene-1-(2-sulfonatosulfanylethyl)-1,2,4-triazole

Systemtic Name: 4-azanyl-3-methyl-5-oxidanylidene-1-(2-sulfonatosulfanylethyl)-1,2,4-triazole Openeye Name: 4-amino-3-methyl-5-oxo-1-(2-sulfonatosulfanylethyl)-1,2,4-triazole CAS Name: 4-amino-3-methyl-5-oxo-1-[2-(sulfonatothio)ethyl]-1,2,4-triazole IUPAC Name: 4-amino-3-methyl-5-oxo-1-(2-sulfonatosulfanylethyl)-1,2,4-triazole Traditional Name: 4-amino-5-keto-3-methyl-1-[2-(sulfonatothio)ethyl]-1,2,4-triazole Formula: C5H9N4O4S2- MolecularWeight: 253.27936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)N1N)CCSS(=O)(=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)N1N)CCSS(=O)(=O)[O-]

InChI

InChI=1S/C5H10N4O4S2/c1-4-7-8(5(10)9(4)6)2-3-14-15(11,12)13/h2-3,6H2,1H3,(H,11,12,13)/p-1