n-[4-[2-[[(2r)-2-hydroxy-2-pyridin-3-ylethyl]amino]ethyl]phenyl]-4-[5-[4-(trifluoromethyl)phenyl]-3h-pyrrol-2-yl]benzenesulfonamide
- Other Name: N-[4-[2-[[(2R)-2-hydroxy-2-pyridin-3-ylethyl]amino]ethyl]phenyl]-4-[5-[4-(trifluoromethyl)phenyl]-3H-pyrrol-2-yl]benzenesulfonamide
- InChIKey: ODRPZOGBOVWNQM-HKBQPEDESA-N
- InChI: InChI=1S/C32H29F3N4O3S/c33-32(34,35)26-9-5-23(6-10-26)29-15-16-30(38-29)24-7-13-28(14-8-24)43(41,42)39-27-11-3-22(4-12-27)17-19-37-21-31(40)25-2-1-18-36-20-25/h1-15,18,20,31,37,39-40H,16-17,19,21H2/t31-/m0/s1
- SMILES: C1C=C(N=C1C2=CC=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)CCNC[C@@H](C4=CN=CC=C4)O)C5=CC=C(C=C5)C(F)(F)F
- Exact Mass: 606.19125
- Molecular Formula: C32H29F3N4O3S
-
Compound CID:
154699840
154699840
Hidden Reactions Filter
Some biological reactions link very small precursors (e.g. CO₂, acetate) to much larger products.
These reactions are correct, but they can create unrealistic shortest paths and connect otherwise separate parts of the graph.
To keep the overview readable, FAIR-TPs hides six such reactions where a <60 Da precursor leads to a >300 Da product in the visualisations.
You can have all these paths in the download output.
You can have all these paths in the download output.
Hidden reaction pairs (precursor → product):
- Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamidoacetamide
- Acetate → N-(2-benzoyl-4-chlorophenyl)-2-acetamido-n-methylacetamide
- Carbon dioxide → Formylmethanofuran
- Acrolein → Chembl3706542
- Ethylene oxide → Acetyl-coa
- Formaldehyde → S-hydroxymethylglutathione
Note: In the graph output, up to 100 compounds are displayed for faster visualization. For the full output, please use the export files.
Click on a node or edge to see details here.