methyl (3Z)-3-(aminocarbonylhydrazinylidene)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]butanoate

Systemtic Name: methyl (3Z)-3-(aminocarbonylhydrazinylidene)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]butanoate Openeye Name: methyl (3Z)-3-(carbamoylhydrazono)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]butanoate CAS Name: (3Z)-3-(carbamoylhydrazinylidene)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]butanoic acid methyl ester IUPAC Name: methyl (3Z)-3-(carbamoylhydrazinylidene)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]butanoate Traditional Name: (3Z)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-semicarbazono-butyric acid methyl ester Formula: C9H14N6O3S MolecularWeight: 286.31086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H14N6O3S/c1-5(12-13-8(10)17)6(7(16)18-3)19-9-14-11-4-15(9)2/h4,6H,1-3H3,(H3,10,13,17)/b12-5-