5-bromanyl-N-[(3,5-dimethylphenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(3,5-dimethylphenyl)carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(3,5-dimethylphenyl)carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[(3,5-dimethylanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(3,5-dimethylphenyl)carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(3,5-dimethylphenyl)thiocarbamoyl]-2-furamide Formula: C14H13BrN2O2S MolecularWeight: 353.23422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=C(O2)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=C(O2)Br)C

InChI

InChI=1S/C14H13BrN2O2S/c1-8-5-9(2)7-10(6-8)16-14(20)17-13(18)11-3-4-12(15)19-11/h3-7H,1-2H3,(H2,16,17,18,20)