2-methylpropyl N-[4-[2-[4-chloranyl-2-[3-cyano-5-(trifluoromethyl)phenyl]carbonyl-phenoxy]ethanoylamino]-3-methyl-phenyl]sulfonylcarbamate

Systemtic Name: 2-methylpropyl N-[4-[2-[4-chloranyl-2-[3-cyano-5-(trifluoromethyl)phenyl]carbonyl-phenoxy]ethanoylamino]-3-methyl-phenyl]sulfonylcarbamate Openeye Name: isobutyl N-[4-[[2-[4-chloro-2-[3-cyano-5-(trifluoromethyl)benzoyl]phenoxy]acetyl]amino]-3-methyl-phenyl]sulfonylcarbamate CAS Name: N-[4-[[2-[4-chloro-2-[[3-cyano-5-(trifluoromethyl)phenyl]-oxomethyl]phenoxy]-1-oxoethyl]amino]-3-methylphenyl]sulfonylcarbamic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-[4-[[2-[4-chloro-2-[3-cyano-5-(trifluoromethyl)benzoyl]phenoxy]acetyl]amino]-3-methylphenyl]sulfonylcarbamate Traditional Name: N-[4-[[2-[4-chloro-2-[3-cyano-5-(trifluoromethyl)benzoyl]phenoxy]acetyl]amino]-3-methyl-phenyl]sulfonylcarbamic acid isobutyl ester Formula: C29H25ClF3N3O7S MolecularWeight: 652.03791

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)OCC(C)C)NC(=O)COC2=C(C=C(C=C2)Cl)C(=O)C3=CC(=CC(=C3)C#N)C(F)(F)F

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC(=O)OCC(C)C)NC(=O)COC2=C(C=C(C=C2)Cl)C(=O)C3=CC(=CC(=C3)C#N)C(F)(F)F

InChI

InChI=1S/C29H25ClF3N3O7S/c1-16(2)14-43-28(39)36-44(40,41)22-5-6-24(17(3)8-22)35-26(37)15-42-25-7-4-21(30)12-23(25)27(38)19-9-18(13-34)10-20(11-19)29(31,32)33/h4-12,16H,14-15H2,1-3H3,(H,35,37)(H,36,39)