1-[(1R)-1-(5-chloranylpyridin-2-yl)-1-[3-fluoranyl-5-(trifluoromethyl)phenyl]-2-(3-methylphenyl)ethyl]-3-(3-fluorophenyl)urea

Systemtic Name: 1-[(1R)-1-(5-chloranylpyridin-2-yl)-1-[3-fluoranyl-5-(trifluoromethyl)phenyl]-2-(3-methylphenyl)ethyl]-3-(3-fluorophenyl)urea Openeye Name: 1-[(1R)-1-(5-chloro-2-pyridyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-(m-tolyl)ethyl]-3-(3-fluorophenyl)urea CAS Name: 1-[(1R)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-(3-methylphenyl)ethyl]-3-(3-fluorophenyl)urea IUPAC Name: 1-[(1R)-1-(5-chloropyridin-2-yl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-(3-methylphenyl)ethyl]-3-(3-fluorophenyl)urea Traditional Name: 1-[(1R)-1-(5-chloro-2-pyridyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-(m-tolyl)ethyl]-3-(3-fluorophenyl)urea Formula: C28H21ClF5N3O MolecularWeight: 545.930856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CC(C2=NC=C(C=C2)Cl)(C3=CC(=CC(=C3)F)C(F)(F)F)NC(=O)NC4=CC(=CC=C4)F

Isomeric SMILES

CC1=CC(=CC=C1)C[C@](C2=NC=C(C=C2)Cl)(C3=CC(=CC(=C3)F)C(F)(F)F)NC(=O)NC4=CC(=CC=C4)F

InChI

InChI=1S/C28H21ClF5N3O/c1-17-4-2-5-18(10-17)15-27(25-9-8-21(29)16-35-25,19-11-20(28(32,33)34)13-23(31)12-19)37-26(38)36-24-7-3-6-22(30)14-24/h2-14,16H,15H2,1H3,(H2,36,37,38)/t27-/m1/s1