(4Z)-4-(4-bromophenyl)-4-(2-methoxyethylcarbamothioylhydrazinylidene)butanoate

Systemtic Name: (4Z)-4-(4-bromophenyl)-4-(2-methoxyethylcarbamothioylhydrazinylidene)butanoate Openeye Name: (4Z)-4-(4-bromophenyl)-4-(2-methoxyethylcarbamothioylhydrazono)butanoate CAS Name: (4Z)-4-(4-bromophenyl)-4-[[(2-methoxyethylamino)-sulfanylidenemethyl]hydrazinylidene]butanoate IUPAC Name: (4Z)-4-(4-bromophenyl)-4-(2-methoxyethylcarbamothioylhydrazinylidene)butanoate Traditional Name: (4Z)-4-(4-bromophenyl)-4-(2-methoxyethylthiocarbamoylhydrazono)butyrate Formula: C14H17BrN3O3S- MolecularWeight: 387.27208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18BrN3O3S/c1-21-9-8-16-14(22)18-17-12(6-7-13(19)20)10-2-4-11(15)5-3-10/h2-5H,6-9H2,1H3,(H,19,20)(H2,16,18,22)/p-1/b17-12-