2-(7-methoxy-4-methyl-quinolin-1-ium-2-yl)sulfanyl-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-(7-methoxy-4-methyl-quinolin-1-ium-2-yl)sulfanyl-N-(3-methylphenyl)ethanamide Openeye Name: 2-(7-methoxy-4-methyl-quinolin-1-ium-2-yl)sulfanyl-N-(m-tolyl)acetamide CAS Name: 2-[(7-methoxy-4-methyl-2-quinolin-1-iumyl)thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-(7-methoxy-4-methylquinolin-1-ium-2-yl)sulfanyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[(7-methoxy-4-methyl-quinolin-1-ium-2-yl)thio]-N-(m-tolyl)acetamide Formula: C20H21N2O2S+ MolecularWeight: 353.45794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSC2=[NH+]C3=C(C=CC(=C3)OC)C(=C2)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSC2=[NH+]C3=C(C=CC(=C3)OC)C(=C2)C

InChI

InChI=1S/C20H20N2O2S/c1-13-5-4-6-15(9-13)21-19(23)12-25-20-10-14(2)17-8-7-16(24-3)11-18(17)22-20/h4-11H,12H2,1-3H3,(H,21,23)/p+1