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

Systemtic Name: 7-(4H-3,1-benzothiazin-2-ylsulfanylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 7-(4H-3,1-benzothiazin-2-ylsulfanylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 7-[(4H-3,1-benzothiazin-2-ylthio)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 7-(4H-3,1-benzothiazin-2-ylsulfanylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 7-[(4H-3,1-benzothiazin-2-ylthio)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C15H12N3OS3+ MolecularWeight: 346.47028

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2N=C(S1)SCC3=CC(=O)[N+]4=C(N3)SC=C4

Isomeric SMILES

C1C2=CC=CC=C2N=C(S1)SCC3=CC(=O)[N+]4=C(N3)SC=C4

InChI

InChI=1S/C15H11N3OS3/c19-13-7-11(16-14-18(13)5-6-20-14)9-22-15-17-12-4-2-1-3-10(12)8-21-15/h1-7H,8-9H2/p+1