2-(4-bromanylphenoxy)-N-[(2-cyanophenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-bromanylphenoxy)-N-[(2-cyanophenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-bromophenoxy)-N-[(2-cyanophenyl)carbamothioyl]acetamide CAS Name: 2-(4-bromophenoxy)-N-[(2-cyanoanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-bromophenoxy)-N-[(2-cyanophenyl)carbamothioyl]acetamide Traditional Name: 2-(4-bromophenoxy)-N-[(2-cyanophenyl)thiocarbamoyl]acetamide Formula: C16H12BrN3O2S MolecularWeight: 390.25438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=S)NC(=O)COC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=S)NC(=O)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C16H12BrN3O2S/c17-12-5-7-13(8-6-12)22-10-15(21)20-16(23)19-14-4-2-1-3-11(14)9-18/h1-8H,10H2,(H2,19,20,21,23)