N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]furan-2-carboxamide

Systemtic Name: N-[[(3-nitrophenyl)carbonylamino]carbamothioyl]furan-2-carboxamide Openeye Name: N-[[(3-nitrobenzoyl)amino]carbamothioyl]furan-2-carboxamide CAS Name: N-[[[(3-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: N-[[(3-nitrobenzoyl)amino]carbamothioyl]furan-2-carboxamide Traditional Name: N-[[(3-nitrobenzoyl)amino]thiocarbamoyl]-2-furamide Formula: C13H10N4O5S MolecularWeight: 334.3073

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NNC(=S)NC(=O)C2=CC=CO2

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NNC(=S)NC(=O)C2=CC=CO2

InChI

InChI=1S/C13H10N4O5S/c18-11(8-3-1-4-9(7-8)17(20)21)15-16-13(23)14-12(19)10-5-2-6-22-10/h1-7H,(H,15,18)(H2,14,16,19,23)