methyl (4E)-4-(4-bromophenyl)-4-(methylcarbamothioylhydrazinylidene)butanoate

Systemtic Name: methyl (4E)-4-(4-bromophenyl)-4-(methylcarbamothioylhydrazinylidene)butanoate Openeye Name: methyl (4E)-4-(4-bromophenyl)-4-(methylcarbamothioylhydrazono)butanoate CAS Name: (4E)-4-(4-bromophenyl)-4-[[methylamino(sulfanylidene)methyl]hydrazinylidene]butanoic acid methyl ester IUPAC Name: methyl (4E)-4-(4-bromophenyl)-4-(methylcarbamothioylhydrazinylidene)butanoate Traditional Name: (4E)-4-(4-bromophenyl)-4-(methylthiocarbamoylhydrazono)butyric acid methyl ester Formula: C13H16BrN3O2S MolecularWeight: 358.25404

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=C(CCC(=O)OC)C1=CC=C(C=C1)Br

Isomeric SMILES

CNC(=S)N/N=C(\CCC(=O)OC)/C1=CC=C(C=C1)Br

InChI

InChI=1S/C13H16BrN3O2S/c1-15-13(20)17-16-11(7-8-12(18)19-2)9-3-5-10(14)6-4-9/h3-6H,7-8H2,1-2H3,(H2,15,17,20)/b16-11+