7-bromanyl-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 7-bromanyl-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 7-bromo-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 7-bromo-2-[(1H-1,2,4-triazol-5-ylthio)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one IUPAC Name: 7-bromo-2-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 7-bromo-2-[(1H-1,2,4-triazol-5-ylthio)methyl]-1H-pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C11H9BrN5OS+ MolecularWeight: 339.19106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=[N+](C=C1Br)C(=O)C=C(N2)CSC3=NC=NN3

Isomeric SMILES

C1=CC2=[N+](C=C1Br)C(=O)C=C(N2)CSC3=NC=NN3

InChI

InChI=1S/C11H8BrN5OS/c12-7-1-2-9-15-8(3-10(18)17(9)4-7)5-19-11-13-6-14-16-11/h1-4,6H,5H2,(H,13,14,16)/p+1