N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide

Systemtic Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-ethanamide Openeye Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-acetamide CAS Name: N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide IUPAC Name: N-[3-(dimethylsulfamoyl)-4-methylphenyl]-2-[2-nitro-4-(trifluoromethyl)phenyl]sulfanylacetamide Traditional Name: N-[3-(dimethylsulfamoyl)-4-methyl-phenyl]-2-[[2-nitro-4-(trifluoromethyl)phenyl]thio]acetamide Formula: C18H18F3N3O5S2 MolecularWeight: 477.47783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])S(=O)(=O)N(C)C

InChI

InChI=1S/C18H18F3N3O5S2/c1-11-4-6-13(9-16(11)31(28,29)23(2)3)22-17(25)10-30-15-7-5-12(18(19,20)21)8-14(15)24(26)27/h4-9H,10H2,1-3H3,(H,22,25)