(4Z)-4-(4-bromophenyl)-4-(methylcarbamothioylhydrazinylidene)butanoate

Systemtic Name: (4Z)-4-(4-bromophenyl)-4-(methylcarbamothioylhydrazinylidene)butanoate Openeye Name: (4Z)-4-(4-bromophenyl)-4-(methylcarbamothioylhydrazono)butanoate CAS Name: (4Z)-4-(4-bromophenyl)-4-[[methylamino(sulfanylidene)methyl]hydrazinylidene]butanoate IUPAC Name: (4Z)-4-(4-bromophenyl)-4-(methylcarbamothioylhydrazinylidene)butanoate Traditional Name: (4Z)-4-(4-bromophenyl)-4-(methylthiocarbamoylhydrazono)butyrate Formula: C12H13BrN3O2S- MolecularWeight: 343.21952

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=C(CCC(=O)[O-])C1=CC=C(C=C1)Br

Isomeric SMILES

CNC(=S)N/N=C(/CCC(=O)[O-])\C1=CC=C(C=C1)Br

InChI

InChI=1S/C12H14BrN3O2S/c1-14-12(19)16-15-10(6-7-11(17)18)8-2-4-9(13)5-3-8/h2-5H,6-7H2,1H3,(H,17,18)(H2,14,16,19)/p-1/b15-10-