5-bromanyl-N-[[3-(furan-2-ylcarbonylamino)phenyl]carbamothioyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[[3-(furan-2-ylcarbonylamino)phenyl]carbamothioyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[[3-(furan-2-carbonylamino)phenyl]carbamothioyl]furan-2-carboxamide CAS Name: 5-bromo-N-[[3-[[2-furanyl(oxo)methyl]amino]anilino]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[[3-(furan-2-carbonylamino)phenyl]carbamothioyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[[3-(2-furoylamino)phenyl]thiocarbamoyl]-2-furamide Formula: C17H12BrN3O4S MolecularWeight: 434.26388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=C(O2)Br)NC(=O)C3=CC=CO3

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=C(O2)Br)NC(=O)C3=CC=CO3

InChI

InChI=1S/C17H12BrN3O4S/c18-14-7-6-13(25-14)16(23)21-17(26)20-11-4-1-3-10(9-11)19-15(22)12-5-2-8-24-12/h1-9H,(H,19,22)(H2,20,21,23,26)