5-bromanyl-N-(pyridin-3-ylmethylcarbamothioyl)furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-(pyridin-3-ylmethylcarbamothioyl)furan-2-carboxamide Openeye Name: 5-bromo-N-(3-pyridylmethylcarbamothioyl)furan-2-carboxamide CAS Name: 5-bromo-N-[(3-pyridinylmethylamino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-(pyridin-3-ylmethylcarbamothioyl)furan-2-carboxamide Traditional Name: 5-bromo-N-(3-pyridylmethylthiocarbamoyl)-2-furamide Formula: C12H10BrN3O2S MolecularWeight: 340.1957

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=S)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

C1=CC(=CN=C1)CNC(=S)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C12H10BrN3O2S/c13-10-4-3-9(18-10)11(17)16-12(19)15-7-8-2-1-5-14-6-8/h1-6H,7H2,(H2,15,16,17,19)