7-[(5-bromanylpyridin-2-yl)sulfanylmethyl]-3-methyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one

Systemtic Name: 7-[(5-bromanylpyridin-2-yl)sulfanylmethyl]-3-methyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 7-[(5-bromo-2-pyridyl)sulfanylmethyl]-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 7-[[(5-bromo-2-pyridinyl)thio]methyl]-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 7-[(5-bromopyridin-2-yl)sulfanylmethyl]-3-methyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 7-[[(5-bromo-2-pyridyl)thio]methyl]-3-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C13H11BrN3OS2+ MolecularWeight: 369.27994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C=C(N2)CSC3=NC=C(C=C3)Br

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C=C(N2)CSC3=NC=C(C=C3)Br

InChI

InChI=1S/C13H10BrN3OS2/c1-8-6-20-13-16-10(4-12(18)17(8)13)7-19-11-3-2-9(14)5-15-11/h2-6H,7H2,1H3/p+1