N-(3-chloranyl-4-methyl-phenyl)-2-[6-(dimethylsulfamoyl)-4-methyl-quinolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[6-(dimethylsulfamoyl)-4-methyl-quinolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[[6-(dimethylsulfamoyl)-4-methyl-2-quinolyl]sulfanyl]acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[[6-(dimethylsulfamoyl)-4-methyl-2-quinolinyl]thio]acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[6-(dimethylsulfamoyl)-4-methylquinolin-2-yl]sulfanylacetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[[6-(dimethylsulfamoyl)-4-methyl-2-quinolyl]thio]acetamide Formula: C21H22ClN3O3S2 MolecularWeight: 464.00068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C=C(C=C3)S(=O)(=O)N(C)C)C(=C2)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(C=C(C=C3)S(=O)(=O)N(C)C)C(=C2)C)Cl

InChI

InChI=1S/C21H22ClN3O3S2/c1-13-5-6-15(10-18(13)22)23-20(26)12-29-21-9-14(2)17-11-16(7-8-19(17)24-21)30(27,28)25(3)4/h5-11H,12H2,1-4H3,(H,23,26)