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

Systemtic Name: ethyl 4-azanyl-2-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1H-imidazole-5-carboxylate Openeye Name: ethyl 4-amino-2-(2-amino-2-oxo-ethyl)sulfanyl-1H-imidazole-5-carboxylate CAS Name: 4-amino-2-[(2-amino-2-oxoethyl)thio]-1H-imidazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-(2-amino-2-oxoethyl)sulfanyl-1H-imidazole-5-carboxylate Traditional Name: 4-amino-2-[(2-amino-2-keto-ethyl)thio]-1H-imidazole-5-carboxylic acid ethyl ester Formula: C8H12N4O3S MolecularWeight: 244.27088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N1)SCC(=O)N)N

Isomeric SMILES

CCOC(=O)C1=C(N=C(N1)SCC(=O)N)N

InChI

InChI=1S/C8H12N4O3S/c1-2-15-7(14)5-6(10)12-8(11-5)16-3-4(9)13/h2-3,10H2,1H3,(H2,9,13)(H,11,12)