1-(2-cyanoethyl)-3-[2-fluoranyl-3-(trifluoromethyl)phenyl]-1-methyl-urea

Systemtic Name: 1-(2-cyanoethyl)-3-[2-fluoranyl-3-(trifluoromethyl)phenyl]-1-methyl-urea Openeye Name: 1-(2-cyanoethyl)-3-[2-fluoro-3-(trifluoromethyl)phenyl]-1-methyl-urea CAS Name: 1-(2-cyanoethyl)-3-[2-fluoro-3-(trifluoromethyl)phenyl]-1-methylurea IUPAC Name: 1-(2-cyanoethyl)-3-[2-fluoro-3-(trifluoromethyl)phenyl]-1-methylurea Traditional Name: 1-(2-cyanoethyl)-3-[2-fluoro-3-(trifluoromethyl)phenyl]-1-methyl-urea Formula: C12H11F4N3O MolecularWeight: 289.228853

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C(=O)NC1=CC=CC(=C1F)C(F)(F)F

Isomeric SMILES

CN(CCC#N)C(=O)NC1=CC=CC(=C1F)C(F)(F)F

InChI

InChI=1S/C12H11F4N3O/c1-19(7-3-6-17)11(20)18-9-5-2-4-8(10(9)13)12(14,15)16/h2,4-5H,3,7H2,1H3,(H,18,20)