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

Systemtic Name: 7-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 7-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 7-[(4-thieno[2,3-d]pyrimidinylthio)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 7-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 7-[(thieno[2,3-d]pyrimidin-4-ylthio)methyl]-8H-thiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C13H9N4OS3+ MolecularWeight: 333.43176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1C(=NC=N2)SCC3=CC(=O)[N+]4=C(N3)SC=C4

Isomeric SMILES

C1=CSC2=C1C(=NC=N2)SCC3=CC(=O)[N+]4=C(N3)SC=C4

InChI

InChI=1S/C13H8N4OS3/c18-10-5-8(16-13-17(10)2-4-20-13)6-21-12-9-1-3-19-11(9)14-7-15-12/h1-5,7H,6H2/p+1