(4Z)-4-(4-bromophenyl)-4-(cyclohexylcarbamothioylhydrazinylidene)butanoate

Systemtic Name: (4Z)-4-(4-bromophenyl)-4-(cyclohexylcarbamothioylhydrazinylidene)butanoate Openeye Name: (4Z)-4-(4-bromophenyl)-4-(cyclohexylcarbamothioylhydrazono)butanoate CAS Name: (4Z)-4-(4-bromophenyl)-4-[[(cyclohexylamino)-sulfanylidenemethyl]hydrazinylidene]butanoate IUPAC Name: (4Z)-4-(4-bromophenyl)-4-(cyclohexylcarbamothioylhydrazinylidene)butanoate Traditional Name: (4Z)-4-(4-bromophenyl)-4-(cyclohexylthiocarbamoylhydrazono)butyrate Formula: C17H21BrN3O2S- MolecularWeight: 411.33654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NN=C(CCC(=O)[O-])C2=CC=C(C=C2)Br

Isomeric SMILES

C1CCC(CC1)NC(=S)N/N=C(/CCC(=O)[O-])\C2=CC=C(C=C2)Br

InChI

InChI=1S/C17H22BrN3O2S/c18-13-8-6-12(7-9-13)15(10-11-16(22)23)20-21-17(24)19-14-4-2-1-3-5-14/h6-9,14H,1-5,10-11H2,(H,22,23)(H2,19,21,24)/p-1/b20-15-