Trifluoroacetic acid → 1-(5-Chloro-benzothiazole-2-sulfonyl)-4-{[2-N-(benzhydryloxycarbonyl)-guanin-9-yl]-acetyl}-piperazin-2-one
Reaction equation
[CH:28]([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)([c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1)[O:41][C:42](=[O:43])[NH:44][c:45]1[nH:46][c:47](=[O:58])[c:48]2[n:49][cH:50][n:51]([CH2:54][C:55](=[O:56])[OH:57])[c:52]2[n:53]1.[Cl:8][c:9]1[cH:10][cH:11][c:12]2[c:13]([n:14][c:15]([S:17](=[O:18])(=[O:19])[N:20]3[C:21](=[O:26])[CH2:22][NH:23][CH2:24][CH2:25]3)[s:16]2)[cH:27]1.[F:1][C:2]([F:3])([F:4])[C:5]([OH:6])=[O:7]>>[Cl:8][c:9]1[cH:10][cH:11][c:12]2[c:13]([n:14][c:15]([S:17](=[O:18])(=[O:19])[N:20]3[C:21](=[O:26])[CH2:22][N:23]([C:55]([CH2:54][n:51]4[cH:50][n:49][c:48]5[c:47](=[O:58])[nH:46][c:45]([NH:44][C:42]([O:41][CH:28]([c:29]6[cH:30][cH:31][cH:32][cH:33][cH:34]6)[c:35]6[cH:36][cH:37][cH:38][cH:39][cH:40]6)=[O:43])[n:53][c:52]54)=[O:56])[CH2:24][CH2:25]3)[s:16]2)[cH:27]1Participants
4
Sources & evidence
- ORD record
- ord-a927bdb15157422da2293b082b79e728
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
Loading…