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

Systemtic Name: 7-methyl-5-oxidanylidene-N-(thiophen-2-ylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Openeye Name: 7-methyl-5-oxo-N-(2-thienylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide CAS Name: 7-methyl-5-oxo-N-(thiophen-2-ylmethyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide IUPAC Name: 7-methyl-5-oxo-N-(thiophen-2-ylmethyl)-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Traditional Name: 5-keto-7-methyl-N-(2-thenyl)-8H-thiazolo[3,2-a]pyrimidin-4-ium-6-sulfonamide Formula: C12H12N3O3S3+ MolecularWeight: 342.43698

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)[N+]2=C(N1)SC=C2)S(=O)(=O)NCC3=CC=CS3

Isomeric SMILES

CC1=C(C(=O)[N+]2=C(N1)SC=C2)S(=O)(=O)NCC3=CC=CS3

InChI

InChI=1S/C12H11N3O3S3/c1-8-10(11(16)15-4-6-20-12(15)14-8)21(17,18)13-7-9-3-2-5-19-9/h2-6,13H,7H2,1H3/p+1