7-bromanyl-2-[[(S)-(2-methylphenyl)methylsulfinyl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 7-bromanyl-2-[[(S)-(2-methylphenyl)methylsulfinyl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-bromo-2-[[(S)-o-tolylmethylsulfinyl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-bromo-2-[[(S)-(2-methylphenyl)methylsulfinyl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 7-bromo-2-[[(S)-(2-methylphenyl)methylsulfinyl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 7-bromo-2-[[(S)-(2-methylbenzyl)sulfinyl]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C17H16BrN2O2S+ MolecularWeight: 392.29014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CS(=O)CC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br

Isomeric SMILES

CC1=CC=CC=C1C[S@](=O)CC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br

InChI

InChI=1S/C17H15BrN2O2S/c1-12-4-2-3-5-13(12)10-23(22)11-15-8-17(21)20-9-14(18)6-7-16(20)19-15/h2-9H,10-11H2,1H3/p+1/t23-/m0/s1