[4-bromanyl-2-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [4-bromanyl-2-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl] 4-chloranylbenzoate Openeye Name: [4-bromo-2-[(E)-(carbamothioylhydrazono)methyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-bromo-2-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(E)-(carbamothioylhydrazinylidene)methyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-bromo-2-[(E)-(thiocarbamoylhydrazono)methyl]phenyl] ester Formula: C15H11BrClN3O2S MolecularWeight: 412.68874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OC2=C(C=C(C=C2)Br)C=NNC(=S)N)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC2=C(C=C(C=C2)Br)/C=N/NC(=S)N)Cl

InChI

InChI=1S/C15H11BrClN3O2S/c16-11-3-6-13(10(7-11)8-19-20-15(18)23)22-14(21)9-1-4-12(17)5-2-9/h1-8H,(H3,18,20,23)/b19-8+