Hydrochloric Acid → {4-[3-Cyano-1-cyclobutyl-6-(2-methanesulfonyl-ethoxy)-1H-indol-2-yl]-phenyl}-carbamic acid 1-cyclopropylethyl ester
Reaction equation
[CH3:40][C:41]#[N:42].[CH3:45][S:46](=[O:47])[O-:48].[CH:1]1([CH:4]([CH3:5])[O:6][C:7]([NH:8][c:9]2[cH:10][cH:11][c:12](-[c:15]3[n:16]([CH:30]4[CH2:31][CH2:32][CH2:33]4)[c:17]4[cH:18][c:19]([O:26][CH2:27][CH2:28][Cl:29])[cH:20][cH:21][c:22]4[c:23]3[C:24]#[N:25])[cH:13][cH:14]2)=[O:34])[CH2:2][CH2:3]1.[ClH:50].[I-:44].[Na+:43].[Na+:49].[O:35]=[CH:36][N:37]([CH3:38])[CH3:39].[O:51]=[CH:52][N:53]([CH3:54])[CH3:55]>>[CH:1]1([CH:4]([CH3:5])[O:6][C:7]([NH:8][c:9]2[cH:10][cH:11][c:12](-[c:15]3[n:16]([CH:30]4[CH2:31][CH2:32][CH2:33]4)[c:17]4[cH:18][c:19]([O:26][CH2:27][CH2:28][S:46]([CH3:45])(=[O:47])=[O:48])[cH:20][cH:21][c:22]4[c:23]3[C:24]#[N:25])[cH:13][cH:14]2)=[O:34])[CH2:2][CH2:3]1Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-a6dc10cb2faf4b3bbe0537d7c0885e18
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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