2-(2,5-dimethyl-3-oxidanylidene-1,2-benzothiazol-1-ium-1-yl)-N-methyl-benzamide chloride

Systemtic Name: 2-(2,5-dimethyl-3-oxidanylidene-1,2-benzothiazol-1-ium-1-yl)-N-methyl-benzamide chloride Openeye Name: 2-(2,5-dimethyl-3-oxo-1,2-benzothiazol-1-ium-1-yl)-N-methyl-benzamide chloride CAS Name: 2-(2,5-dimethyl-3-oxo-1,2-benzothiazol-1-ium-1-yl)-N-methylbenzamide chloride IUPAC Name: 2-(2,5-dimethyl-3-oxo-1,2-benzothiazol-1-ium-1-yl)-N-methylbenzamide chloride Traditional Name: 2-(3-keto-2,5-dimethyl-1,2-benzothiazol-1-ium-1-yl)-N-methyl-benzamide chloride Formula: C17H17ClN2O2S MolecularWeight: 348.84708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)[S+](N(C2=O)C)C3=CC=CC=C3C(=O)NC.[Cl-]

Isomeric SMILES

CC1=CC2=C(C=C1)[S+](N(C2=O)C)C3=CC=CC=C3C(=O)NC.[Cl-]

InChI

InChI=1S/C17H16N2O2S.ClH/c1-11-8-9-15-13(10-11)17(21)19(3)22(15)14-7-5-4-6-12(14)16(20)18-2;/h4-10H,1-3H3;1H