Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Ethanol | HCID 702 | — |
| Reactant | Acetic Anhydride | HCID 7918 | — |
| Reactant | 4'-Mercaptoacetanilide | HCID 70777 | — |
| Reactant | 1-Methyl-3-n-propyl-2-pyrazolin-5-one | HCID 520516 | — |
| Reactant | Quinoline, 4-chloro-, 1-oxide | HCID 3741098 | — |
| Reactant | HCID 178440344 | HCID 178440344 | — |
| Product | HCID 178440346 | HCID 178440346 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (3/10) |
|---|
| ORD ID | ord-897074f1de8a47c39a2d7ecbccaae9ec |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (3/10) |
|---|
