Hydrochloric Acid → 4,5-Dichloro-1-ethyl-1H-indole-2-carboxylic acid (4-{4-[2-(2,4-dioxo-thiazolidin-5-yl)-acetyl]-piperazin-1-yl}-phenyl)-amide
Reaction equation
[ClH:1].[N:41]1([c:47]2[cH:48][cH:49][c:50]([NH:53][C:54](=[O:55])[c:56]3[n:57]([CH2:67][CH3:68])[c:58]4[cH:59][cH:60][c:61]([Cl:66])[c:62]([Cl:65])[c:63]4[cH:64]3)[cH:51][cH:52]2)[CH2:42][CH2:43][NH:44][CH2:45][CH2:46]1.[O:2]=[C:3]1[S:4][CH:5]([CH2:9][C:10](=[O:11])[N:12]2[CH2:13][CH2:14][N:15]([c:16]3[cH:17][cH:18][c:19]([NH:20][C:21]([c:22]4[n:23]([CH2:24][CH3:25])[c:26]5[c:27]([cH:28]4)[c:29]([O:30][CH2:31][CH3:32])[cH:33][cH:34][cH:35]5)=[O:36])[cH:37][cH:38]3)[CH2:39][CH2:40]2)[C:6](=[O:8])[NH:7]1.[O:69]=[C:70]1[NH:71][C:72](=[O:73])[CH:74]([CH2:75][C:76]([OH:77])=[O:78])[S:79]1>>[O:2]=[C:3]1[S:4][CH:5]([CH2:9][C:10](=[O:11])[N:44]2[CH2:43][CH2:42][N:41]([c:47]3[cH:48][cH:49][c:50]([NH:53][C:54](=[O:55])[c:56]4[n:57]([CH2:67][CH3:68])[c:58]5[cH:59][cH:60][c:61]([Cl:66])[c:62]([Cl:65])[c:63]5[cH:64]4)[cH:51][cH:52]3)[CH2:46][CH2:45]2)[C:6](=[O:8])[NH:7]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-91112a3883074a6e8bc60159b035261f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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