4-[(4-methylphenyl)-methylsulfonyl-amino]-N-[3-(trifluoromethyl)phenyl]butanamide

Systemtic Name: 4-[(4-methylphenyl)-methylsulfonyl-amino]-N-[3-(trifluoromethyl)phenyl]butanamide Openeye Name: 4-(4-methyl-N-methylsulfonyl-anilino)-N-[3-(trifluoromethyl)phenyl]butanamide CAS Name: 4-(4-methyl-N-methylsulfonylanilino)-N-[3-(trifluoromethyl)phenyl]butanamide IUPAC Name: 4-(4-methyl-N-methylsulfonylanilino)-N-[3-(trifluoromethyl)phenyl]butanamide Traditional Name: 4-(N-mesyl-4-methyl-anilino)-N-[3-(trifluoromethyl)phenyl]butyramide Formula: C19H21F3N2O3S MolecularWeight: 414.44185

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CCCC(=O)NC2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CCCC(=O)NC2=CC=CC(=C2)C(F)(F)F)S(=O)(=O)C

InChI

InChI=1S/C19H21F3N2O3S/c1-14-8-10-17(11-9-14)24(28(2,26)27)12-4-7-18(25)23-16-6-3-5-15(13-16)19(20,21)22/h3,5-6,8-11,13H,4,7,12H2,1-2H3,(H,23,25)