1-[(1-phenethylpiperidin-3-yl)methyl]-1-phenyl-3-[4-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[(1-phenethylpiperidin-3-yl)methyl]-1-phenyl-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-[(1-phenethyl-3-piperidyl)methyl]-1-phenyl-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-[(1-phenethyl-3-piperidinyl)methyl]-1-phenyl-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[(1-phenethylpiperidin-3-yl)methyl]-1-phenyl-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-[(1-phenethyl-3-piperidyl)methyl]-1-phenyl-3-[4-(trifluoromethyl)phenyl]urea Formula: C28H30F3N3O MolecularWeight: 481.55251

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCC2=CC=CC=C2)CN(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CC(CN(C1)CCC2=CC=CC=C2)CN(C3=CC=CC=C3)C(=O)NC4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C28H30F3N3O/c29-28(30,31)24-13-15-25(16-14-24)32-27(35)34(26-11-5-2-6-12-26)21-23-10-7-18-33(20-23)19-17-22-8-3-1-4-9-22/h1-6,8-9,11-16,23H,7,10,17-21H2,(H,32,35)