3-[(methoxyamino)methylidene]-2-(4-methylphenyl)sulfanyl-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 3-[(methoxyamino)methylidene]-2-(4-methylphenyl)sulfanyl-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 3-[(methoxyamino)methylene]-2-(p-tolylsulfanyl)pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 3-[(methoxyamino)methylidene]-2-[(4-methylphenyl)thio]-4-pyrido[1,2-a]pyrimidin-5-iumone IUPAC Name: 3-[(methoxyamino)methylidene]-2-(4-methylphenyl)sulfanylpyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 3-[(methoxyamino)methylene]-2-(p-tolylthio)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=CC=C(C=C1)SC2=NC3=CC=CC=[N+]3C(=O)C2=CNOC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC3=CC=CC=[N+]3C(=O)C2=CNOC

InChI

InChI=1S/C17H15N3O2S/c1-12-6-8-13(9-7-12)23-16-14(11-18-22-2)17(21)20-10-4-3-5-15(20)19-16/h3-11H,1-2H3/p+1