N-(5-chloranyl-2-methyl-phenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[(4,6,8-trimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[(4,6,8-trimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-(4,6,8-trimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(5-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=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=C(C=C(C=C3C(=C2)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=C(C=C(C=C3C(=C2)C)C)C

InChI

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