Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Chloride | HCID 312 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Toluene | HCID 1140 | — |
| Reactant | Triethylamine | HCID 8471 | — |
| Reactant | 1,2-Benzisothiazole-3-carboxylic acid | HCID 94512 | — |
| Reactant | 1-Piperazinebutanamine, 4-(1,2-benzisothiazol-3-yl)- | HCID 10565462 | — |
| Product | Hydrochloric Acid | HCID 313 | — |
| Product | Benzo[d]isothiazole-3-carboxylic acid [4-(4-benzo[d]isothiazol-3-yl-piperazin-1-yl)-butyl]-amide | HCID 3073070 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (6/10) |
|---|
| ORD ID | ord-6018f934c0da4795925b78264f2bc6d6 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (6/10) |
|---|
