7-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 7-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]thiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-[[(1-oxido-2-pyridin-1-iumyl)thio]methyl]-5-thiazolo[3,2-a]pyrimidinone IUPAC Name: 7-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one Traditional Name: 7-[[(1-oxidopyridin-1-ium-2-yl)thio]methyl]thiazolo[3,2-a]pyrimidin-5-one Formula: C12H9N3O2S2 MolecularWeight: 291.34876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC2=CC(=O)N3C=CSC3=N2)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCC2=CC(=O)N3C=CSC3=N2)[O-]

InChI

InChI=1S/C12H9N3O2S2/c16-10-7-9(13-12-14(10)5-6-18-12)8-19-11-3-1-2-4-15(11)17/h1-7H,8H2