methyl 5-(2-azanyl-2-oxidanylidene-ethyl)-2-methylsulfanyl-1H-imidazole-4-carboxylate

Systemtic Name: methyl 5-(2-azanyl-2-oxidanylidene-ethyl)-2-methylsulfanyl-1H-imidazole-4-carboxylate Openeye Name: methyl 5-(2-amino-2-oxo-ethyl)-2-methylsulfanyl-1H-imidazole-4-carboxylate CAS Name: 5-(2-amino-2-oxoethyl)-2-(methylthio)-1H-imidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 5-(2-amino-2-oxoethyl)-2-methylsulfanyl-1H-imidazole-4-carboxylate Traditional Name: 5-(2-amino-2-keto-ethyl)-2-(methylthio)-1H-imidazole-4-carboxylic acid methyl ester Formula: C8H11N3O3S MolecularWeight: 229.25624

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=N1)SC)CC(=O)N

Isomeric SMILES

COC(=O)C1=C(NC(=N1)SC)CC(=O)N

InChI

InChI=1S/C8H11N3O3S/c1-14-7(13)6-4(3-5(9)12)10-8(11-6)15-2/h3H2,1-2H3,(H2,9,12)(H,10,11)