N-[3,5-bis(trifluoromethyl)phenyl]-2-[(4-methylphenyl)sulfonyl-phenethyl-amino]ethanamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[(4-methylphenyl)sulfonyl-phenethyl-amino]ethanamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[phenethyl(p-tolylsulfonyl)amino]acetamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[(4-methylphenyl)sulfonyl-phenethylamino]acetamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[(4-methylphenyl)sulfonyl-phenethylamino]acetamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-[phenethyl(tosyl)amino]acetamide Formula: C25H22F6N2O3S MolecularWeight: 544.509199

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCC2=CC=CC=C2)CC(=O)NC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C25H22F6N2O3S/c1-17-7-9-22(10-8-17)37(35,36)33(12-11-18-5-3-2-4-6-18)16-23(34)32-21-14-19(24(26,27)28)13-20(15-21)25(29,30)31/h2-10,13-15H,11-12,16H2,1H3,(H,32,34)