Methyl 3-cyclohexyl-1-methyl-2-{2-[2-(methyl {4-[methyl(sulfamoyl)amino]butyl}amino)-2-oxoethoxy]phenyl}-1H-indole-6-carboxylate → 3-cyclohexyl-1-methyl-2-{2-[2-(methyl {4-[methyl(sulfamoyl)amino]butyl}amino)-2-oxoethoxy]phenyl}-1H-indole-6-carboxylic acid
Reaction equation
[CH:1]1([c:7]2[c:8](-[c:21]3[c:22]([O:27][CH2:28][C:29](=[O:30])[N:31]([CH2:32][CH2:33][CH2:34][CH2:35][N:36]([S:37]([NH2:38])(=[O:39])=[O:40])[CH3:41])[CH3:42])[cH:23][cH:24][cH:25][cH:26]3)[n:9]([CH3:20])[c:10]3[cH:11][c:12]([C:16](=[O:17])[O:18][CH3:19])[cH:13][cH:14][c:15]23)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[CH:43]1([c:44]2[c:45]3[c:46]([cH:47][c:48]([C:49]([OH:50])=[O:51])[cH:52][cH:53]3)[n:54]([CH3:55])[c:56]2-[c:57]2[cH:58][cH:59][cH:60][cH:61][c:62]2[O:63][CH2:64][C:65]([N:66]([CH3:67])[CH2:68][CH2:69][O:70][CH2:71][CH2:72][N:73]([CH3:74])[S:75](=[O:76])(=[O:77])[NH2:78])=[O:79])[CH2:80][CH2:81][CH2:82][CH2:83][CH2:84]1>>[CH:1]1([c:7]2[c:8](-[c:21]3[c:22]([O:27][CH2:28][C:29](=[O:30])[N:31]([CH2:32][CH2:33][CH2:34][CH2:35][N:36]([S:37]([NH2:38])(=[O:39])=[O:40])[CH3:41])[CH3:42])[cH:23][cH:24][cH:25][cH:26]3)[n:9]([CH3:20])[c:10]3[cH:11][c:12]([C:16](=[O:17])[OH:18])[cH:13][cH:14][c:15]23)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-6e490165c8d04aeca49e736dde5c8af0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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