N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide

Systemtic Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide Openeye Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanyl-propanamide CAS Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-[[2-(trifluoromethyl)-4-quinazolinyl]thio]propanamide IUPAC Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-[2-(trifluoromethyl)quinazolin-4-yl]sulfanylpropanamide Traditional Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-[[2-(trifluoromethyl)quinazolin-4-yl]thio]propionamide Formula: C21H21F3N4O3S2 MolecularWeight: 498.54165

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C(C)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C(C)SC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C21H21F3N4O3S2/c1-12-9-10-14(33(30,31)28(3)4)11-17(12)25-18(29)13(2)32-19-15-7-5-6-8-16(15)26-20(27-19)21(22,23)24/h5-11,13H,1-4H3,(H,25,29)