N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]furan-2-carboxamide

Systemtic Name: N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]furan-2-carboxamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)carbamothioyl]furan-2-carboxamide CAS Name: N-[(2-hydroxy-5-nitroanilino)-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)carbamothioyl]furan-2-carboxamide Traditional Name: N-[(2-hydroxy-5-nitro-phenyl)thiocarbamoyl]-2-furamide Formula: C12H9N3O5S MolecularWeight: 307.28196

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

C1=COC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C12H9N3O5S/c16-9-4-3-7(15(18)19)6-8(9)13-12(21)14-11(17)10-2-1-5-20-10/h1-6,16H,(H2,13,14,17,21)