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

Systemtic Name: 7-methyl-5-oxidanylidene-N-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Openeye Name: 7-methyl-5-oxo-N-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide CAS Name: 7-methyl-5-oxo-N-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide IUPAC Name: 7-methyl-5-oxo-N-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Traditional Name: 5-keto-7-methyl-N-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Formula: C13H12N3O3S2+ MolecularWeight: 322.38268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)[N+]2=C(N1)SC=C2)S(=O)(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)[N+]2=C(N1)SC=C2)S(=O)(=O)NC3=CC=CC=C3

InChI

InChI=1S/C13H11N3O3S2/c1-9-11(12(17)16-7-8-20-13(16)14-9)21(18,19)15-10-5-3-2-4-6-10/h2-8,15H,1H3/p+1