1-(2-cyanoethyl)-1-(furan-2-ylmethyl)-3-[4-(trifluoromethyloxy)phenyl]urea

Systemtic Name: 1-(2-cyanoethyl)-1-(furan-2-ylmethyl)-3-[4-(trifluoromethyloxy)phenyl]urea Openeye Name: 1-(2-cyanoethyl)-1-(2-furylmethyl)-3-[4-(trifluoromethoxy)phenyl]urea CAS Name: 1-(2-cyanoethyl)-1-(2-furanylmethyl)-3-[4-(trifluoromethoxy)phenyl]urea IUPAC Name: 1-(2-cyanoethyl)-1-(furan-2-ylmethyl)-3-[4-(trifluoromethoxy)phenyl]urea Traditional Name: 1-(2-cyanoethyl)-1-(2-furfuryl)-3-[4-(trifluoromethoxy)phenyl]urea Formula: C16H14F3N3O3 MolecularWeight: 353.29587

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN(CCC#N)C(=O)NC2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

C1=COC(=C1)CN(CCC#N)C(=O)NC2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C16H14F3N3O3/c17-16(18,19)25-13-6-4-12(5-7-13)21-15(23)22(9-2-8-20)11-14-3-1-10-24-14/h1,3-7,10H,2,9,11H2,(H,21,23)