2-azanyl-4-methylsulfanyl-5-pyridin-3-yloxy-2-[2-[2-(trifluoromethyl)phenyl]phenyl]carbonyl-pentanoic acid

Systemtic Name: 2-azanyl-4-methylsulfanyl-5-pyridin-3-yloxy-2-[2-[2-(trifluoromethyl)phenyl]phenyl]carbonyl-pentanoic acid Openeye Name: 2-amino-4-methylsulfanyl-5-(3-pyridyloxy)-2-[2-[2-(trifluoromethyl)phenyl]benzoyl]pentanoic acid CAS Name: 2-amino-4-(methylthio)-2-[oxo-[2-[2-(trifluoromethyl)phenyl]phenyl]methyl]-5-(3-pyridinyloxy)pentanoic acid IUPAC Name: 2-amino-4-methylsulfanyl-5-pyridin-3-yloxy-2-[2-[2-(trifluoromethyl)phenyl]benzoyl]pentanoic acid Traditional Name: 2-amino-4-(methylthio)-5-(3-pyridyloxy)-2-[2-[2-(trifluoromethyl)phenyl]benzoyl]valeric acid Formula: C25H23F3N2O4S MolecularWeight: 504.52133

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC(CC(C(=O)C1=CC=CC=C1C2=CC=CC=C2C(F)(F)F)(C(=O)O)N)COC3=CN=CC=C3

Isomeric SMILES

CSC(CC(C(=O)C1=CC=CC=C1C2=CC=CC=C2C(F)(F)F)(C(=O)O)N)COC3=CN=CC=C3

InChI

InChI=1S/C25H23F3N2O4S/c1-35-17(15-34-16-7-6-12-30-14-16)13-24(29,23(32)33)22(31)20-10-3-2-8-18(20)19-9-4-5-11-21(19)25(26,27)28/h2-12,14,17H,13,15,29H2,1H3,(H,32,33)