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

Systemtic Name: 4-[(3,4-dimethylphenyl)-methylsulfonyl-amino]-N-[4-(trifluoromethyl)phenyl]butanamide Openeye Name: 4-(3,4-dimethyl-N-methylsulfonyl-anilino)-N-[4-(trifluoromethyl)phenyl]butanamide CAS Name: 4-(3,4-dimethyl-N-methylsulfonylanilino)-N-[4-(trifluoromethyl)phenyl]butanamide IUPAC Name: 4-(3,4-dimethyl-N-methylsulfonylanilino)-N-[4-(trifluoromethyl)phenyl]butanamide Traditional Name: 4-(N-mesyl-3,4-dimethyl-anilino)-N-[4-(trifluoromethyl)phenyl]butyramide Formula: C20H23F3N2O3S MolecularWeight: 428.46843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23F3N2O3S/c1-14-6-11-18(13-15(14)2)25(29(3,27)28)12-4-5-19(26)24-17-9-7-16(8-10-17)20(21,22)23/h6-11,13H,4-5,12H2,1-3H3,(H,24,26)