7-(pyridin-2-ylsulfanylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one

Systemtic Name: 7-(pyridin-2-ylsulfanylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 7-(2-pyridylsulfanylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 7-[(2-pyridinylthio)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 7-(pyridin-2-ylsulfanylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 7-[(2-pyridylthio)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C12H10N3OS2+ MolecularWeight: 276.3573

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SCC2=CC(=O)[N+]3=C(N2)SC=C3

Isomeric SMILES

C1=CC=NC(=C1)SCC2=CC(=O)[N+]3=C(N2)SC=C3

InChI

InChI=1S/C12H9N3OS2/c16-11-7-9(14-12-15(11)5-6-17-12)8-18-10-3-1-2-4-13-10/h1-7H,8H2/p+1