3,5-bis(bromanyl)-2-(furan-2-ylcarbonylcarbamothioylamino)benzoic acid

Systemtic Name: 3,5-bis(bromanyl)-2-(furan-2-ylcarbonylcarbamothioylamino)benzoic acid Openeye Name: 3,5-dibromo-2-(furan-2-carbonylcarbamothioylamino)benzoic acid CAS Name: 3,5-dibromo-2-[[[[2-furanyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 3,5-dibromo-2-(furan-2-carbonylcarbamothioylamino)benzoic acid Traditional Name: 3,5-dibromo-2-(2-furoylthiocarbamoylamino)benzoic acid Formula: C13H8Br2N2O4S MolecularWeight: 448.08662

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2C(=O)O)Br)Br

Isomeric SMILES

C1=COC(=C1)C(=O)NC(=S)NC2=C(C=C(C=C2C(=O)O)Br)Br

InChI

InChI=1S/C13H8Br2N2O4S/c14-6-4-7(12(19)20)10(8(15)5-6)16-13(22)17-11(18)9-2-1-3-21-9/h1-5H,(H,19,20)(H2,16,17,18,22)