N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide

Systemtic Name: N-[(5-nitro-2-oxidanyl-phenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide Openeye Name: N-[(2-hydroxy-5-nitro-phenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide CAS Name: N-[(2-hydroxy-5-nitroanilino)-sulfanylidenemethyl]-5-(3-nitrophenyl)-2-furancarboxamide IUPAC Name: N-[(2-hydroxy-5-nitrophenyl)carbamothioyl]-5-(3-nitrophenyl)furan-2-carboxamide Traditional Name: N-[(2-hydroxy-5-nitro-phenyl)thiocarbamoyl]-5-(3-nitrophenyl)-2-furamide Formula: C18H12N4O7S MolecularWeight: 428.37548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)NC(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CC=C(O2)C(=O)NC(=S)NC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H12N4O7S/c23-14-5-4-12(22(27)28)9-13(14)19-18(30)20-17(24)16-7-6-15(29-16)10-2-1-3-11(8-10)21(25)26/h1-9,23H,(H2,19,20,24,30)