methyl (2E)-2-(dimethylcarbamoylimino)-5-ethylsulfonyl-1,3,4-thiadiazole-3-carboxylate

Systemtic Name: methyl (2E)-2-(dimethylcarbamoylimino)-5-ethylsulfonyl-1,3,4-thiadiazole-3-carboxylate Openeye Name: methyl (2E)-2-(dimethylcarbamoylimino)-5-ethylsulfonyl-1,3,4-thiadiazole-3-carboxylate CAS Name: (2E)-2-[dimethylamino(oxo)methyl]imino-5-ethylsulfonyl-1,3,4-thiadiazole-3-carboxylic acid methyl ester IUPAC Name: methyl (2E)-2-(dimethylcarbamoylimino)-5-ethylsulfonyl-1,3,4-thiadiazole-3-carboxylate Traditional Name: (2E)-2-(dimethylcarbamoylimino)-5-esyl-1,3,4-thiadiazole-3-carboxylic acid methyl ester Formula: C9H14N4O5S2 MolecularWeight: 322.36126

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NN(C(=NC(=O)N(C)C)S1)C(=O)OC

Isomeric SMILES

CCS(=O)(=O)C1=NN(/C(=N\C(=O)N(C)C)/S1)C(=O)OC

InChI

InChI=1S/C9H14N4O5S2/c1-5-20(16,17)8-11-13(9(15)18-4)7(19-8)10-6(14)12(2)3/h5H2,1-4H3/b10-7+