2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-N-methylsulfonyl-ethanamide

Systemtic Name: 2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-N-methylsulfonyl-ethanamide Openeye Name: 2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-N-methylsulfonyl-acetamide CAS Name: 2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-N-methylsulfonylacetamide IUPAC Name: 2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)-N-methylsulfonylacetamide Traditional Name: N-mesyl-2-(2-methyl-1,3-benzothiazol-3-ium-3-yl)acetamide Formula: C11H13N2O3S2+ MolecularWeight: 285.36252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2S1)CC(=O)NS(=O)(=O)C

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2S1)CC(=O)NS(=O)(=O)C

InChI

InChI=1S/C11H12N2O3S2/c1-8-13(7-11(14)12-18(2,15)16)9-5-3-4-6-10(9)17-8/h3-6H,7H2,1-2H3/p+1