7-bromanyl-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 7-bromanyl-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-bromo-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-bromo-2-[[(5-methyl-1,3,4-oxadiazol-2-yl)thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 7-bromo-2-[(5-methyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 7-bromo-2-[[(5-methyl-1,3,4-oxadiazol-2-yl)thio]methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C12H10BrN4O2S+ MolecularWeight: 354.2024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(O1)SCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br

Isomeric SMILES

CC1=NN=C(O1)SCC2=CC(=O)[N+]3=C(N2)C=CC(=C3)Br

InChI

InChI=1S/C12H9BrN4O2S/c1-7-15-16-12(19-7)20-6-9-4-11(18)17-5-8(13)2-3-10(17)14-9/h2-5H,6H2,1H3/p+1