9-methyl-3-[(oxidanylamino)methylidene]-2-(phenylmethylsulfanyl)pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 9-methyl-3-[(oxidanylamino)methylidene]-2-(phenylmethylsulfanyl)pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-benzylsulfanyl-3-[(hydroxyamino)methylene]-9-methyl-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 3-[(hydroxyamino)methylidene]-9-methyl-2-(phenylmethylthio)-4-pyrido[1,2-a]pyrimidin-5-iumone IUPAC Name: 2-benzylsulfanyl-3-[(hydroxyamino)methylidene]-9-methylpyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-(benzylthio)-3-[(hydroxyamino)methylene]-9-methyl-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C17H16N3O2S+ MolecularWeight: 326.39284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2N=C(C(=CNO)C(=O)[N+]2=CC=C1)SCC3=CC=CC=C3

Isomeric SMILES

CC1=C2N=C(C(=CNO)C(=O)[N+]2=CC=C1)SCC3=CC=CC=C3

InChI

InChI=1S/C17H15N3O2S/c1-12-6-5-9-20-15(12)19-16(14(10-18-22)17(20)21)23-11-13-7-3-2-4-8-13/h2-10,22H,11H2,1H3/p+1