2-[2,4-bis(fluoranyl)phenyl]-3-[4-[(1E,3E)-2-methyl-4-[4-(trifluoromethyloxy)phenyl]buta-1,3-dienyl]cyclohexyl]sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-3-[4-[(1E,3E)-2-methyl-4-[4-(trifluoromethyloxy)phenyl]buta-1,3-dienyl]cyclohexyl]sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol Openeye Name: 2-(2,4-difluorophenyl)-3-[4-[(1E,3E)-2-methyl-4-[4-(trifluoromethoxy)phenyl]buta-1,3-dienyl]cyclohexyl]sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol CAS Name: 2-(2,4-difluorophenyl)-3-[[4-[(1E,3E)-2-methyl-4-[4-(trifluoromethoxy)phenyl]buta-1,3-dienyl]cyclohexyl]thio]-1-(1,2,4-triazol-1-yl)-2-butanol IUPAC Name: 2-(2,4-difluorophenyl)-3-[4-[(1E,3E)-2-methyl-4-[4-(trifluoromethoxy)phenyl]buta-1,3-dienyl]cyclohexyl]sulfanyl-1-(1,2,4-triazol-1-yl)butan-2-ol Traditional Name: 2-(2,4-difluorophenyl)-3-[[4-[(1E,3E)-2-methyl-4-[4-(trifluoromethoxy)phenyl]buta-1,3-dienyl]cyclohexyl]thio]-1-(1,2,4-triazol-1-yl)butan-2-ol Formula: C30H32F5N3O2S MolecularWeight: 593.650996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)SC3CCC(CC3)C=C(C)C=CC4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)SC3CCC(CC3)/C=C(\C)/C=C/C4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C30H32F5N3O2S/c1-20(3-4-22-5-10-25(11-6-22)40-30(33,34)35)15-23-7-12-26(13-8-23)41-21(2)29(39,17-38-19-36-18-37-38)27-14-9-24(31)16-28(27)32/h3-6,9-11,14-16,18-19,21,23,26,39H,7-8,12-13,17H2,1-2H3/b4-3+,20-15+