methyl (3Z)-3-(aminocarbonylhydrazinylidene)-2-(1-methylimidazol-2-yl)sulfanyl-butanoate

Systemtic Name: methyl (3Z)-3-(aminocarbonylhydrazinylidene)-2-(1-methylimidazol-2-yl)sulfanyl-butanoate Openeye Name: methyl (3Z)-3-(carbamoylhydrazono)-2-(1-methylimidazol-2-yl)sulfanyl-butanoate CAS Name: (3Z)-3-(carbamoylhydrazinylidene)-2-[(1-methyl-2-imidazolyl)thio]butanoic acid methyl ester IUPAC Name: methyl (3Z)-3-(carbamoylhydrazinylidene)-2-(1-methylimidazol-2-yl)sulfanylbutanoate Traditional Name: (3Z)-2-[(1-methylimidazol-2-yl)thio]-3-semicarbazono-butyric acid methyl ester Formula: C10H15N5O3S MolecularWeight: 285.3228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)N)C(C(=O)OC)SC1=NC=CN1C

Isomeric SMILES

C/C(=N/NC(=O)N)/C(C(=O)OC)SC1=NC=CN1C

InChI

InChI=1S/C10H15N5O3S/c1-6(13-14-9(11)17)7(8(16)18-3)19-10-12-4-5-15(10)2/h4-5,7H,1-3H3,(H3,11,14,17)/b13-6-