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

Systemtic Name: 3-[(Z)-3-azanyl-2-cyano-3-oxidanylidene-prop-1-enyl]-N-oxidanyl-2-sulfanylidene-1H-benzimidazol-5-amine oxide Openeye Name: 3-[(Z)-3-amino-2-cyano-3-oxo-prop-1-enyl]-N-hydroxy-2-thioxo-1H-benzimidazol-5-amine oxide CAS Name: 3-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-N-hydroxy-2-sulfanylidene-1H-benzimidazol-5-amine oxide IUPAC Name: 3-[(Z)-3-amino-2-cyano-3-oxoprop-1-enyl]-N-hydroxy-2-sulfanylidene-1H-benzimidazol-5-amine oxide Traditional Name: 3-[(Z)-3-amino-2-cyano-3-keto-prop-1-enyl]-N-hydroxy-2-thioxo-1H-benzimidazol-5-amine oxide Formula: C11H9N5O3S MolecularWeight: 291.28586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[NH+](O)[O-])N(C(=S)N2)C=C(C#N)C(=O)N

Isomeric SMILES

C1=CC2=C(C=C1[NH+](O)[O-])N(C(=S)N2)/C=C(/C#N)\C(=O)N

InChI

InChI=1S/C11H9N5O3S/c12-4-6(10(13)17)5-15-9-3-7(16(18)19)1-2-8(9)14-11(15)20/h1-3,5,16,18H,(H2,13,17)(H,14,20)/b6-5-