(2S,3S)-3-azaniumyl-2-methyl-4-sulfanylidene-azetidine-1-sulfonate

Systemtic Name: (2S,3S)-3-azaniumyl-2-methyl-4-sulfanylidene-azetidine-1-sulfonate Openeye Name: (2S,3S)-3-azaniumyl-2-methyl-4-thioxo-azetidine-1-sulfonate CAS Name: (2S,3S)-3-ammonio-2-methyl-4-sulfanylidene-1-azetidinesulfonate IUPAC Name: (2S,3S)-3-azaniumyl-2-methyl-4-sulfanylideneazetidine-1-sulfonate Traditional Name: (2S,3S)-3-ammonio-2-methyl-4-thioxo-azetidine-1-sulfonate Formula: C4H8N2O3S2 MolecularWeight: 196.24792

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=S)N1S(=O)(=O)[O-])[NH3+]

Isomeric SMILES

C[C@H]1[C@@H](C(=S)N1S(=O)(=O)[O-])[NH3+]

InChI

InChI=1S/C4H8N2O3S2/c1-2-3(5)4(10)6(2)11(7,8)9/h2-3H,5H2,1H3,(H,7,8,9)/t2-,3-/m0/s1