[4-bromanyl-2-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]phenyl] benzoate

Systemtic Name: [4-bromanyl-2-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]phenyl] benzoate Openeye Name: [4-bromo-2-[(E)-(ethylcarbamothioylhydrazono)methyl]phenyl] benzoate CAS Name: benzoic acid [4-bromo-2-[(E)-[[ethylamino(sulfanylidene)methyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-(ethylcarbamothioylhydrazinylidene)methyl]phenyl] benzoate Traditional Name: benzoic acid [4-bromo-2-[(E)-(ethylthiocarbamoylhydrazono)methyl]phenyl] ester Formula: C17H16BrN3O2S MolecularWeight: 406.29684

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=C(C=CC(=C1)Br)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCNC(=S)N/N=C/C1=C(C=CC(=C1)Br)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H16BrN3O2S/c1-2-19-17(24)21-20-11-13-10-14(18)8-9-15(13)23-16(22)12-6-4-3-5-7-12/h3-11H,2H2,1H3,(H2,19,21,24)/b20-11+