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

Systemtic Name: N-(3-ethanoylphenyl)-3,7-dimethyl-5-oxidanylidene-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Openeye Name: N-(3-acetylphenyl)-3,7-dimethyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide CAS Name: N-(3-acetylphenyl)-3,7-dimethyl-5-oxo-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide IUPAC Name: N-(3-acetylphenyl)-3,7-dimethyl-5-oxo-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Traditional Name: N-(3-acetylphenyl)-5-keto-3,7-dimethyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Formula: C16H16N3O4S2+ MolecularWeight: 378.44594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=[N+]1C(=O)C(=C(N2)C)S(=O)(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CSC2=[N+]1C(=O)C(=C(N2)C)S(=O)(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C16H15N3O4S2/c1-9-8-24-16-17-10(2)14(15(21)19(9)16)25(22,23)18-13-6-4-5-12(7-13)11(3)20/h4-8,18H,1-3H3/p+1