3-azanyl-2-(1,3-dithietan-2-ylcarbonylimino)-3-oxidanylidene-propanoic acid

Systemtic Name: 3-azanyl-2-(1,3-dithietan-2-ylcarbonylimino)-3-oxidanylidene-propanoic acid Openeye Name: 3-amino-2-(1,3-dithietane-2-carbonylimino)-3-oxo-propanoic acid CAS Name: 3-amino-2-[1,3-dithietan-2-yl(oxo)methyl]imino-3-oxopropanoic acid IUPAC Name: 3-amino-2-(1,3-dithietane-2-carbonylimino)-3-oxopropanoic acid Traditional Name: 3-amino-2-(1,3-dithietane-2-carbonylimino)-3-keto-propionic acid Formula: C6H6N2O4S2 MolecularWeight: 234.25284

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Descriptors Computed from Structure

Canonical SMILES:

C1SC(S1)C(=O)N=C(C(=O)N)C(=O)O

Isomeric SMILES

C1SC(S1)C(=O)N=C(C(=O)N)C(=O)O

InChI

InChI=1S/C6H6N2O4S2/c7-3(9)2(5(11)12)8-4(10)6-13-1-14-6/h6H,1H2,(H2,7,9)(H,11,12)