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

Systemtic Name: methyl (3Z)-2-(1-methylimidazol-2-yl)sulfanyl-3-(phenylcarbamoylhydrazinylidene)butanoate Openeye Name: methyl (3Z)-2-(1-methylimidazol-2-yl)sulfanyl-3-(phenylcarbamoylhydrazono)butanoate CAS Name: (3Z)-3-[[anilino(oxo)methyl]hydrazinylidene]-2-[(1-methyl-2-imidazolyl)thio]butanoic acid methyl ester IUPAC Name: methyl (3Z)-2-(1-methylimidazol-2-yl)sulfanyl-3-(phenylcarbamoylhydrazinylidene)butanoate Traditional Name: (3Z)-2-[(1-methylimidazol-2-yl)thio]-3-(phenylcarbamoylhydrazono)butyric acid methyl ester Formula: C16H19N5O3S MolecularWeight: 361.41876

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)NC1=CC=CC=C1)C(C(=O)OC)SC2=NC=CN2C

Isomeric SMILES

C/C(=N/NC(=O)NC1=CC=CC=C1)/C(C(=O)OC)SC2=NC=CN2C

InChI

InChI=1S/C16H19N5O3S/c1-11(19-20-15(23)18-12-7-5-4-6-8-12)13(14(22)24-3)25-16-17-9-10-21(16)2/h4-10,13H,1-3H3,(H2,18,20,23)/b19-11-