About 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid
2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid (PubChem CID 160772930) has the molecular formula C90H61ClF18N10O10S5
and a molecular weight of 1980.29 g/mol. Its IUPAC name is 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid.
Analyze 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid with MolForge
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Frequently Asked Questions
What is the IUPAC name of 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid?
The IUPAC name of 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid (CID 160772930) is 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid.
What is the SMILES notation for 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid?
The canonical SMILES for 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid is Cc1ccc(C(F)(F)F)c(CSc2ncc(C(=O)O)n2-c2ccc(F)cc2)c1.Cc1cccc(CSc2ncc(C(=O)O)n2-c2ccc(F)cc2)c1F.O=C(O)c1cnc(SCc2cc(F)ccc2F)n1-c1ccc(F)cc1.O=C(O)c1cnc(SCc2ccc(Cl)cc2C(F)(F)F)n1-c1ccc(F)cc1.O=C(O)c1cnc(SCc2ccc(F)cc2C(F)(F)F)n1-c1ccc(F)cc1.
What is the InChIKey of 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid?
The InChIKey is RZOCLLGAHYOYQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F4N2O2S.C18H11ClF4N2O2S.C18H11F5N2O2S.C18H14F2N2O2S.C17H11F3N2O2S/c1-11-2-7-15(19(21,22)23)12(8-11)10-28-18-24-9-16(17(26)27)25(18)14-5-3-13(20)4-6-14;19-11-2-1-10(14(7-11)18(21,22)23)9-28-17-24-8-15(16(26)27)25(17)13-5-3-12(20)4-6-13;19-11-3-5-13(6-4-11)25-15(16(26)27)8-24-17(25)28-9-10-1-2-12(20)7-14(10)18(21,22)23;1-11-3-2-4-12(16(11)20)10-25-18-21-9-15(17(23)24)22(18)14-7-5-13(19)6-8-14;18-11-1-4-13(5-2-11)22-15(16(23)24)8-21-17(22)25-9-10-7-12(19)3-6-14(10)20/h2-9H,10H2,1H3,(H,26,27);2*1-8H,9H2,(H,26,27);2-9H,10H2,1H3,(H,23,24);1-8H,9H2,(H,23,24).
What are the key properties of 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid?
2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid has a molecular weight of 1980.29 g/mol, XLogP of 24.89, 25 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-chloro-2-(trifluoromethyl)phenyl]methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2,5-difluorophenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;2-[(2-fluoro-3-methylphenyl)methylsulfanyl]-3-(4-fluorophenyl)imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[4-fluoro-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid;3-(4-fluorophenyl)-2-[[5-methyl-2-(trifluoromethyl)phenyl]methylsulfanyl]imidazole-4-carboxylic acid is sourced from PubChem (CID 160772930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).