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

Systemtic Name: 5-bromanyl-N-[(hexanoylamino)carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(hexanoylamino)carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[(1-oxohexylhydrazo)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(hexanoylamino)carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(caproylamino)thiocarbamoyl]-2-furamide Formula: C12H16BrN3O3S MolecularWeight: 362.24274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NNC(=S)NC(=O)C1=CC=C(O1)Br

Isomeric SMILES

CCCCCC(=O)NNC(=S)NC(=O)C1=CC=C(O1)Br

InChI

InChI=1S/C12H16BrN3O3S/c1-2-3-4-5-10(17)15-16-12(20)14-11(18)8-6-7-9(13)19-8/h6-7H,2-5H2,1H3,(H,15,17)(H2,14,16,18,20)