N-(3-ethoxypropyl)-7-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide

Systemtic Name: N-(3-ethoxypropyl)-7-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Openeye Name: N-(3-ethoxypropyl)-7-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide CAS Name: N-(3-ethoxypropyl)-7-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide IUPAC Name: N-(3-ethoxypropyl)-7-methyl-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Traditional Name: N-(3-ethoxypropyl)-5-keto-7-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Formula: C12H18N3O4S2+ MolecularWeight: 332.41902

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNS(=O)(=O)C1=C(NC2=[N+](C1=O)C=CS2)C

Isomeric SMILES

CCOCCCNS(=O)(=O)C1=C(NC2=[N+](C1=O)C=CS2)C

InChI

InChI=1S/C12H17N3O4S2/c1-3-19-7-4-5-13-21(17,18)10-9(2)14-12-15(11(10)16)6-8-20-12/h6,8,13H,3-5,7H2,1-2H3/p+1