Methanol → 2-(4-(2-(3-(Aminomethyl)-4-(ethylsulfonyl)phenylamino)-2-oxoethoxy)-3,5-dimethylphenyl)-2-(1-(bis(tert-butoxycarbonyl)amino)isoquinolin-6-ylamino)acetic acid
Reaction equation
[CH2:1]([O:2][C:3](=[O:4])[NH:11][CH2:12][c:13]1[cH:14][c:15]([NH:24][C:25]([CH2:26][O:27][c:28]2[c:29]([CH3:65])[cH:30][c:31]([CH:35]([C:36](=[O:37])[OH:38])[NH:39][c:40]3[cH:41][c:42]4[cH:43][cH:44][n:45][c:46]([N:50]([C:51](=[O:52])[O:53][C:54]([CH3:55])([CH3:56])[CH3:57])[C:58](=[O:59])[O:60][C:61]([CH3:62])([CH3:63])[CH3:64])[c:47]4[cH:48][cH:49]3)[cH:32][c:33]2[CH3:34])=[O:66])[cH:16][cH:17][c:18]1[S:19](=[O:20])(=[O:21])[CH2:22][CH3:23])[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[CH3:67][OH:68]>>[NH2:11][CH2:12][c:13]1[cH:14][c:15]([NH:24][C:25]([CH2:26][O:27][c:28]2[c:29]([CH3:65])[cH:30][c:31]([CH:35]([C:36](=[O:37])[OH:38])[NH:39][c:40]3[cH:41][c:42]4[cH:43][cH:44][n:45][c:46]([N:50]([C:51](=[O:52])[O:53][C:54]([CH3:55])([CH3:56])[CH3:57])[C:58](=[O:59])[O:60][C:61]([CH3:62])([CH3:63])[CH3:64])[c:47]4[cH:48][cH:49]3)[cH:32][c:33]2[CH3:34])=[O:66])[cH:16][cH:17][c:18]1[S:19](=[O:20])(=[O:21])[CH2:22][CH3:23]Participants
3
Reactant 2
Product 1
Sources & evidence
- ORD record
- ord-41f0c8bc09ab4c24bce6f11b7c864105
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
Loading…