Methanol → 1-(6-(5-cyanopyrazin-2-ylamino)-4-(piperidin-3-ylmethylamino)pyridin-3-yl)-1H-pyrrole-3-carboxylic acid
Reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH:10]([CH2:14][NH:15][c:16]2[c:17](-[n:31]3[cH:32][c:33]([C:36](=[O:37])[OH:38])[cH:34][cH:35]3)[cH:18][n:19][c:20]([NH:22][c:23]3[n:24][cH:25][c:26]([C:29]#[N:30])[n:27][cH:28]3)[cH:21]2)[CH2:11][CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[CH3:39][OH:40]>>[NH:8]1[CH2:9][CH:10]([CH2:14][NH:15][c:16]2[c:17](-[n:31]3[cH:32][c:33]([C:36](=[O:37])[OH:38])[cH:34][cH:35]3)[cH:18][n:19][c:20]([NH:22][c:23]3[n:24][cH:25][c:26]([C:29]#[N:30])[n:27][cH:28]3)[cH:21]2)[CH2:11][CH2:12][CH2:13]1Participants
3
Sources & evidence
- ORD record
- ord-ba5dcfeab7784dd89ee3b7152cbba4aa
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…