N-butyl-N-(cyanomethyl)-2-[[4-cyano-3-(trifluoromethyl)phenyl]-[2,2,2-tris(fluoranyl)ethyl]amino]butanamide

Systemtic Name: N-butyl-N-(cyanomethyl)-2-[[4-cyano-3-(trifluoromethyl)phenyl]-[2,2,2-tris(fluoranyl)ethyl]amino]butanamide Openeye Name: N-butyl-N-(cyanomethyl)-2-[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]butanamide CAS Name: N-butyl-N-(cyanomethyl)-2-[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]butanamide IUPAC Name: N-butyl-N-(cyanomethyl)-2-[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]butanamide Traditional Name: N-butyl-N-(cyanomethyl)-2-[4-cyano-N-(2,2,2-trifluoroethyl)-3-(trifluoromethyl)anilino]butyramide Formula: C20H22F6N4O MolecularWeight: 448.405299

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC#N)C(=O)C(CC)N(CC(F)(F)F)C1=CC(=C(C=C1)C#N)C(F)(F)F

Isomeric SMILES

CCCCN(CC#N)C(=O)C(CC)N(CC(F)(F)F)C1=CC(=C(C=C1)C#N)C(F)(F)F

InChI

InChI=1S/C20H22F6N4O/c1-3-5-9-29(10-8-27)18(31)17(4-2)30(13-19(21,22)23)15-7-6-14(12-28)16(11-15)20(24,25)26/h6-7,11,17H,3-5,9-10,13H2,1-2H3