methyl (2S)-3-oxidanyl-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate

Systemtic Name: methyl (2S)-3-oxidanyl-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate Openeye Name: methyl (2S)-3-hydroxy-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate CAS Name: (2S)-3-hydroxy-2-[[oxo-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)amino]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-hydroxy-2-[(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propanoate Traditional Name: (2S)-3-hydroxy-2-[(2-thioxo-3H-1,3,4-thiadiazol-5-yl)carbamoylamino]propionic acid methyl ester Formula: C7H10N4O4S2 MolecularWeight: 278.3087

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)NC1=NNC(=S)S1

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)NC1=NNC(=S)S1

InChI

InChI=1S/C7H10N4O4S2/c1-15-4(13)3(2-12)8-5(14)9-6-10-11-7(16)17-6/h3,12H,2H2,1H3,(H,11,16)(H2,8,9,10,14)/t3-/m0/s1