1-[2,5-bis(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-ethyl-methanesulfonamide

Systemtic Name: 1-[2,5-bis(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-ethyl-methanesulfonamide Openeye Name: 1-[2,5-bis(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-ethyl-methanesulfonamide CAS Name: 1-[2,5-bis(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-ethylmethanesulfonamide IUPAC Name: 1-[2,5-bis(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-ethylmethanesulfonamide Traditional Name: 1-[2,5-bis(trifluoromethyl)phenyl]-N-(cyanomethyl)-N-ethyl-methanesulfonamide Formula: C13H12F6N2O2S MolecularWeight: 374.301999

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC#N)S(=O)(=O)CC1=C(C=CC(=C1)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCN(CC#N)S(=O)(=O)CC1=C(C=CC(=C1)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C13H12F6N2O2S/c1-2-21(6-5-20)24(22,23)8-9-7-10(12(14,15)16)3-4-11(9)13(17,18)19/h3-4,7H,2,6,8H2,1H3