Isopropanol → 2-(2-Isopropylsulfanyl-benzoylamino)-indan-2-carboxylic acid ethyl ester
Reaction equation
[CH2:17]([CH3:18])[O:19][C:20](=[O:21])[C:22]1([NH2:31])[CH2:23][c:24]2[cH:25][cH:26][cH:27][cH:28][c:29]2[CH2:30]1.[CH:1]([CH3:2])([CH3:3])[S:4][c:5]1[c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11][cH:12][cH:13]1.[CH:32]([N:33]([CH2:34][CH3:35])[CH:36]([CH3:37])[CH3:38])([CH3:39])[CH3:40].[CH:41]([OH:42])([CH3:43])[CH3:44].[Cl:14][CH2:15][Cl:16].[Cl:45][CH2:46][Cl:47]>>[CH:1]([CH3:2])([CH3:3])[S:4][c:5]1[c:6]([C:7](=[O:9])[NH:31][C:22]2([C:20]([O:19][CH2:17][CH3:18])=[O:21])[CH2:23][c:24]3[cH:25][cH:26][cH:27][cH:28][c:29]3[CH2:30]2)[cH:10][cH:11][cH:12][cH:13]1Participants
6
Sources & evidence
- ORD record
- ord-b9b3a97c55854bb385da5739b30762b0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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