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

Systemtic Name: ethyl (3Z)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-(phenylcarbamoylhydrazinylidene)butanoate Openeye Name: ethyl (3Z)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-(phenylcarbamoylhydrazono)butanoate CAS Name: (3Z)-3-[[anilino(oxo)methyl]hydrazinylidene]-2-[(4-methyl-1,2,4-triazol-3-yl)thio]butanoic acid ethyl ester IUPAC Name: ethyl (3Z)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-(phenylcarbamoylhydrazinylidene)butanoate Traditional Name: (3Z)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-(phenylcarbamoylhydrazono)butyric acid ethyl ester Formula: C16H20N6O3S MolecularWeight: 376.4334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=NNC(=O)NC1=CC=CC=C1)C)SC2=NN=CN2C

Isomeric SMILES

CCOC(=O)C(/C(=N\NC(=O)NC1=CC=CC=C1)/C)SC2=NN=CN2C

InChI

InChI=1S/C16H20N6O3S/c1-4-25-14(23)13(26-16-21-17-10-22(16)3)11(2)19-20-15(24)18-12-8-6-5-7-9-12/h5-10,13H,4H2,1-3H3,(H2,18,20,24)/b19-11-