5-oxidanyl-7-oxidanylidene-N-(thiophen-2-ylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide

Systemtic Name: 5-oxidanyl-7-oxidanylidene-N-(thiophen-2-ylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Openeye Name: 5-hydroxy-7-oxo-N-(2-thienylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide CAS Name: 5-hydroxy-7-oxo-N-(thiophen-2-ylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide IUPAC Name: 5-hydroxy-7-oxo-N-(thiophen-2-ylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Traditional Name: 5-hydroxy-7-keto-N-(2-thenyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-carboxamide Formula: C12H10N3O3S2+ MolecularWeight: 308.3561

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CNC(=O)C2=C([N+]3=C(NC2=O)SC=C3)O

Isomeric SMILES

C1=CSC(=C1)CNC(=O)C2=C([N+]3=C(NC2=O)SC=C3)O

InChI

InChI=1S/C12H9N3O3S2/c16-9(13-6-7-2-1-4-19-7)8-10(17)14-12-15(11(8)18)3-5-20-12/h1-5H,6H2,(H2,13,16,17,18)/p+1