ethyl (3E)-2-ethyl-3-(phenylcarbamothioylhydrazinylidene)butanoate

Systemtic Name: ethyl (3E)-2-ethyl-3-(phenylcarbamothioylhydrazinylidene)butanoate Openeye Name: ethyl (3E)-2-ethyl-3-(phenylcarbamothioylhydrazono)butanoate CAS Name: (3E)-3-[[anilino(sulfanylidene)methyl]hydrazinylidene]-2-ethylbutanoic acid ethyl ester IUPAC Name: ethyl (3E)-2-ethyl-3-(phenylcarbamothioylhydrazinylidene)butanoate Traditional Name: (3E)-2-ethyl-3-(phenylthiocarbamoylhydrazono)butyric acid ethyl ester Formula: C15H21N3O2S MolecularWeight: 307.41114

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=NNC(=S)NC1=CC=CC=C1)C)C(=O)OCC

Isomeric SMILES

CCC(/C(=N/NC(=S)NC1=CC=CC=C1)/C)C(=O)OCC

InChI

InChI=1S/C15H21N3O2S/c1-4-13(14(19)20-5-2)11(3)17-18-15(21)16-12-9-7-6-8-10-12/h6-10,13H,4-5H2,1-3H3,(H2,16,18,21)/b17-11+