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

Systemtic Name: N-(2,5-diethoxyphenyl)-7-methyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Openeye Name: N-(2,5-diethoxyphenyl)-7-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide CAS Name: N-(2,5-diethoxyphenyl)-7-methyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide IUPAC Name: N-(2,5-diethoxyphenyl)-7-methyl-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Traditional Name: N-(2,5-diethoxyphenyl)-5-keto-7-methyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Formula: C17H20N3O5S2+ MolecularWeight: 410.4878

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NS(=O)(=O)C2=C(NC3=[N+](C2=O)C=CS3)C

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NS(=O)(=O)C2=C(NC3=[N+](C2=O)C=CS3)C

InChI

InChI=1S/C17H19N3O5S2/c1-4-24-12-6-7-14(25-5-2)13(10-12)19-27(22,23)15-11(3)18-17-20(16(15)21)8-9-26-17/h6-10,19H,4-5H2,1-3H3/p+1