3-[(Z)-2-ethoxycarbonyl-3-oxidanylidene-3-phenyl-prop-1-enyl]-N-oxidanyl-2-sulfanylidene-1H-benzimidazol-5-amine oxide

Systemtic Name: 3-[(Z)-2-ethoxycarbonyl-3-oxidanylidene-3-phenyl-prop-1-enyl]-N-oxidanyl-2-sulfanylidene-1H-benzimidazol-5-amine oxide Openeye Name: 3-[(Z)-2-benzoyl-3-ethoxy-3-oxo-prop-1-enyl]-N-hydroxy-2-thioxo-1H-benzimidazol-5-amine oxide CAS Name: 3-[(Z)-2-benzoyl-3-ethoxy-3-oxoprop-1-enyl]-N-hydroxy-2-sulfanylidene-1H-benzimidazol-5-amine oxide IUPAC Name: 3-[(Z)-2-benzoyl-3-ethoxy-3-oxoprop-1-enyl]-N-hydroxy-2-sulfanylidene-1H-benzimidazol-5-amine oxide Traditional Name: 3-[(Z)-2-benzoyl-3-ethoxy-3-keto-prop-1-enyl]-N-hydroxy-2-thioxo-1H-benzimidazol-5-amine oxide Formula: C19H17N3O5S MolecularWeight: 399.42038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CN1C2=C(C=CC(=C2)[NH+](O)[O-])NC1=S)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)/C(=C\N1C2=C(C=CC(=C2)[NH+](O)[O-])NC1=S)/C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O5S/c1-2-27-18(24)14(17(23)12-6-4-3-5-7-12)11-21-16-10-13(22(25)26)8-9-15(16)20-19(21)28/h3-11,22,25H,2H2,1H3,(H,20,28)/b14-11-