A1IJ3
3-[[2-methyl-3-(trifluoromethyl)phenyl]methyl]-2,4-bis(oxidanylidene)-1-[4-(2-oxidanylideneimidazolidin-1-yl)phenyl]pyrimidine-5-carboxylic acid
Find entries where: A1IJ3
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | 3-[[2-methyl-3-(trifluoromethyl)phenyl]methyl]-2,4-bis(oxidanylidene)-1-[4-(2-oxidanylideneimidazolidin-1-yl)phenyl]pyrimidine-5-carboxylic acid |
Identifiers | 3-[[2-methyl-3-(trifluoromethyl)phenyl]methyl]-2,4-bis(oxidanylidene)-1-[4-(2-oxidanylideneimidazolidin-1-yl)phenyl]pyrimidine-5-carboxylic acid |
Formula | C23 H19 F3 N4 O5 |
Molecular Weight | 488.416 |
Type | NON-POLYMER |
Isomeric SMILES | Cc1c(cccc1C(F)(F)F)CN2C(=O)C(=CN(C2=O)c3ccc(cc3)N4CCNC4=O)C(=O)O |
InChI | InChI=1S/C23H19F3N4O5/c1-13-14(3-2-4-18(13)23(24,25)26)11-30-19(31)17(20(32)33)12-29(22(30)35)16-7-5-15(6-8-16)28-10-9-27-21(28)34/h2-8,12H,9-11H2,1H3,(H,27,34)(H,32,33) |
InChIKey | MUZPDPKTCZSNCS-UHFFFAOYSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 54 |
Chiral Atom Count | 0 |
Bond Count | 57 |
Aromatic Bond Count | 12 |