Acetic Acid → 5-(4-Methanesulfonyl-piperazin-1-ylmethyl)-2-(2-oxo-1,2-dihydro-quinolin-3-yl)-indole-1-carboxylic acid tert-butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9](-[c:19]2[c:20](=[O:29])[nH:21][c:22]3[cH:23][cH:24][cH:25][cH:26][c:27]3[cH:28]2)[cH:10][c:11]2[cH:12][c:13]([CH:17]=[O:18])[cH:14][cH:15][c:16]12.[C:30]([OH:31])(=[O:32])[CH3:33].[C:44]([O:45][BH-:46]([O:47][C:48](=[O:49])[CH3:50])[O:51][C:52](=[O:53])[CH3:54])(=[O:55])[CH3:56].[CH3:34][S:35](=[O:36])(=[O:37])[N:38]1[CH2:39][CH2:40][NH:41][CH2:42][CH2:43]1.[CH3:69][C:70](=[O:71])[OH:72].[Cl:65][CH:66]([Cl:67])[CH3:68].[H-:64].[Mg+2:58].[Na+:57].[O-:59][S:60]([O-:61])(=[O:62])=[O:63]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9](-[c:19]2[c:20](=[O:29])[nH:21][c:22]3[cH:23][cH:24][cH:25][cH:26][c:27]3[cH:28]2)[cH:10][c:11]2[cH:12][c:13]([CH2:17][N:41]3[CH2:40][CH2:39][N:38]([S:35]([CH3:34])(=[O:36])=[O:37])[CH2:43][CH2:42]3)[cH:14][cH:15][c:16]12Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-a38b612d0eea4566a49dc3e3725f72f1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…