2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-9-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carboxaldehyde IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-9-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-4-keto-9-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-3-carbaldehyde Formula: C16H15N4O2S+ MolecularWeight: 327.3809

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=O)SC3=NC(=CC(=N3)C)C

Isomeric SMILES

CC1=C2NC(=C(C(=O)[N+]2=CC=C1)C=O)SC3=NC(=CC(=N3)C)C

InChI

InChI=1S/C16H14N4O2S/c1-9-5-4-6-20-13(9)19-14(12(8-21)15(20)22)23-16-17-10(2)7-11(3)18-16/h4-8H,1-3H3/p+1