Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Potassium Cation | HCID 813 | — |
| Reactant | Acetonitrile | HCID 6342 | — |
| Reactant | Diisopropylamine | HCID 7912 | — |
| Reactant | Carbonate Ion | HCID 19660 | — |
| Reactant | (4-(2-Thiophenylsulfonyl)-1-(4-(2,2,2-trifluoro-1-hydroxy-1-methylethyl)phenyl)-2-piperazinyl)methyl methanesulfonate | HCID 86670324 | — |
| Product | HCID 76462433 | HCID 76462433 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
| ORD ID | ord-018771b63d5f47199eada31dc215ff40 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
