(2R,3R)-2-[2,4-bis(fluoranyl)phenyl]-1-(1,2,4-triazol-1-yl)-3-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfinyl-butan-2-ol

Systemtic Name: (2R,3R)-2-[2,4-bis(fluoranyl)phenyl]-1-(1,2,4-triazol-1-yl)-3-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfinyl-butan-2-ol Openeye Name: (2R,3R)-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)-3-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfinyl-butan-2-ol CAS Name: (2R,3R)-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)-3-[[4-[4-(trifluoromethyl)phenyl]-1-piperazinyl]sulfinyl]-2-butanol IUPAC Name: (2R,3R)-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)-3-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]sulfinylbutan-2-ol Traditional Name: (2R,3R)-2-(2,4-difluorophenyl)-1-(1,2,4-triazol-1-yl)-3-[4-[4-(trifluoromethyl)phenyl]piperazino]sulfinyl-butan-2-ol Formula: C23H24F5N5O2S MolecularWeight: 529.525976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)S(=O)N3CCN(CC3)C4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C[C@H]([C@](CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)S(=O)N3CCN(CC3)C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C23H24F5N5O2S/c1-16(22(34,13-32-15-29-14-30-32)20-7-4-18(24)12-21(20)25)36(35)33-10-8-31(9-11-33)19-5-2-17(3-6-19)23(26,27)28/h2-7,12,14-16,34H,8-11,13H2,1H3/t16-,22-,36?/m1/s1