[azanyl(sulfanyl)methylidene]-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]azanium

Systemtic Name: [azanyl(sulfanyl)methylidene]-[(3-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]azanium Openeye Name: [amino(sulfanyl)methylene]-[(3-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]ammonium CAS Name: [amino(mercapto)methylidene]-[(3-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]ammonium IUPAC Name: [amino(sulfanyl)methylidene]-[(3-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]azanium Traditional Name: [amino(mercapto)methylene]-[(4-keto-3-methoxy-cyclohexa-2,5-dien-1-ylidene)methylamino]ammonium Formula: C9H12N3O2S+ MolecularWeight: 226.27548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CN[NH+]=C(N)S)C=CC1=O

Isomeric SMILES

COC1=CC(=CN[NH+]=C(N)S)C=CC1=O

InChI

InChI=1S/C9H11N3O2S/c1-14-8-4-6(2-3-7(8)13)5-11-12-9(10)15/h2-5,11H,1H3,(H3,10,12,15)/p+1