6-oxidanylidene-3-phenyl-2-sulfanyl-1H-pyrimidin-3-ium-4-carbaldehyde

Systemtic Name: 6-oxidanylidene-3-phenyl-2-sulfanyl-1H-pyrimidin-3-ium-4-carbaldehyde Openeye Name: 6-oxo-3-phenyl-2-sulfanyl-1H-pyrimidin-3-ium-4-carbaldehyde CAS Name: 2-mercapto-6-oxo-3-phenyl-1H-pyrimidin-3-ium-4-carboxaldehyde IUPAC Name: 6-oxo-3-phenyl-2-sulfanyl-1H-pyrimidin-3-ium-4-carbaldehyde Traditional Name: 6-keto-2-mercapto-3-phenyl-1H-pyrimidin-3-ium-4-carbaldehyde Formula: C11H9N2O2S+ MolecularWeight: 233.26636

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[N+]2=C(NC(=O)C=C2C=O)S

Isomeric SMILES

C1=CC=C(C=C1)[N+]2=C(NC(=O)C=C2C=O)S

InChI

InChI=1S/C11H8N2O2S/c14-7-9-6-10(15)12-11(16)13(9)8-4-2-1-3-5-8/h1-7H,(H,12,15,16)/p+1