N-(3-chloranyl-2-methyl-phenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[(4,6,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[(4,6,8-trimethyl-2-quinolyl)thio]acetamide Formula: C21H21ClN2OS MolecularWeight: 384.92224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)NC3=C(C(=CC=C3)Cl)C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CC(=N2)SCC(=O)NC3=C(C(=CC=C3)Cl)C)C)C

InChI

InChI=1S/C21H21ClN2OS/c1-12-8-14(3)21-16(9-12)13(2)10-20(24-21)26-11-19(25)23-18-7-5-6-17(22)15(18)4/h5-10H,11H2,1-4H3,(H,23,25)