(3R,4R)-3-[(2R)-2-(4-chloranyl-3-fluoranyl-phenyl)-2-oxidanyl-ethyl]sulfanyl-1-[4-(5-fluoranylpyridin-3-yl)phenyl]-4-(4-hydroxyphenyl)azetidin-2-one

Systemtic Name: (3R,4R)-3-[(2R)-2-(4-chloranyl-3-fluoranyl-phenyl)-2-oxidanyl-ethyl]sulfanyl-1-[4-(5-fluoranylpyridin-3-yl)phenyl]-4-(4-hydroxyphenyl)azetidin-2-one Openeye Name: (3R,4R)-3-[(2R)-2-(4-chloro-3-fluoro-phenyl)-2-hydroxy-ethyl]sulfanyl-1-[4-(5-fluoro-3-pyridyl)phenyl]-4-(4-hydroxyphenyl)azetidin-2-one CAS Name: (3R,4R)-3-[[(2R)-2-(4-chloro-3-fluorophenyl)-2-hydroxyethyl]thio]-1-[4-(5-fluoro-3-pyridinyl)phenyl]-4-(4-hydroxyphenyl)-2-azetidinone IUPAC Name: (3R,4R)-3-[(2R)-2-(4-chloro-3-fluorophenyl)-2-hydroxyethyl]sulfanyl-1-[4-(5-fluoropyridin-3-yl)phenyl]-4-(4-hydroxyphenyl)azetidin-2-one Traditional Name: (3R,4R)-3-[[(2R)-2-(4-chloro-3-fluoro-phenyl)-2-hydroxy-ethyl]thio]-1-[4-(5-fluoro-3-pyridyl)phenyl]-4-(4-hydroxyphenyl)azetidin-2-one Formula: C28H21ClF2N2O3S MolecularWeight: 538.992746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2C(C(=O)N2C3=CC=C(C=C3)C4=CC(=CN=C4)F)SCC(C5=CC(=C(C=C5)Cl)F)O)O

Isomeric SMILES

C1=CC(=CC=C1[C@@H]2[C@H](C(=O)N2C3=CC=C(C=C3)C4=CC(=CN=C4)F)SC[C@@H](C5=CC(=C(C=C5)Cl)F)O)O

InChI

InChI=1S/C28H21ClF2N2O3S/c29-23-10-5-18(12-24(23)31)25(35)15-37-27-26(17-3-8-22(34)9-4-17)33(28(27)36)21-6-1-16(2-7-21)19-11-20(30)14-32-13-19/h1-14,25-27,34-35H,15H2/t25-,26+,27+/m0/s1