S-[2-[(1-methylcyclohexyl)carbonylamino]-4-(trifluoromethyl)phenyl] 2,2-dimethylpropanethioate

Systemtic Name: S-[2-[(1-methylcyclohexyl)carbonylamino]-4-(trifluoromethyl)phenyl] 2,2-dimethylpropanethioate Openeye Name: S-[2-[(1-methylcyclohexanecarbonyl)amino]-4-(trifluoromethyl)phenyl] 2,2-dimethylpropanethioate CAS Name: 2,2-dimethylpropanethioic acid S-[2-[[(1-methylcyclohexyl)-oxomethyl]amino]-4-(trifluoromethyl)phenyl] ester IUPAC Name: S-[2-[(1-methylcyclohexanecarbonyl)amino]-4-(trifluoromethyl)phenyl] 2,2-dimethylpropanethioate Traditional Name: 2,2-dimethylpropanethioic acid S-[2-[(1-methylcyclohexanecarbonyl)amino]-4-(trifluoromethyl)phenyl] ester Formula: C20H26F3NO2S MolecularWeight: 401.48615

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCCC1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)SC(=O)C(C)(C)C

Isomeric SMILES

CC1(CCCCC1)C(=O)NC2=C(C=CC(=C2)C(F)(F)F)SC(=O)C(C)(C)C

InChI

InChI=1S/C20H26F3NO2S/c1-18(2,3)17(26)27-15-9-8-13(20(21,22)23)12-14(15)24-16(25)19(4)10-6-5-7-11-19/h8-9,12H,5-7,10-11H2,1-4H3,(H,24,25)