5-bromanyl-N-[(2-cyanophenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(2-cyanophenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(2-cyanophenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[(2-cyanoanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(2-cyanophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(2-cyanophenyl)thiocarbamoyl]-2-furamide Formula: C13H8BrN3O2S MolecularWeight: 350.19052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)NC(=S)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

C1=CC=C(C(=C1)C#N)NC(=S)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C13H8BrN3O2S/c14-11-6-5-10(19-11)12(18)17-13(20)16-9-4-2-1-3-8(9)7-15/h1-6H,(H2,16,17,18,20)