4-oxidanylidene-2-pyridin-2-ylsulfanyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde

Systemtic Name: 4-oxidanylidene-2-pyridin-2-ylsulfanyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Openeye Name: 4-oxo-2-(2-pyridylsulfanyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde CAS Name: 4-oxo-2-(2-pyridinylthio)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxaldehyde IUPAC Name: 4-oxo-2-pyridin-2-ylsulfanyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Traditional Name: 4-keto-2-(2-pyridylthio)-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Formula: C14H10N3O2S+ MolecularWeight: 284.3131

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SC2=C(C(=O)[N+]3=CC=CC=C3N2)C=O

Isomeric SMILES

C1=CC=NC(=C1)SC2=C(C(=O)[N+]3=CC=CC=C3N2)C=O

InChI

InChI=1S/C14H9N3O2S/c18-9-10-13(20-12-6-1-3-7-15-12)16-11-5-2-4-8-17(11)14(10)19/h1-9H/p+1