Tetrahydrofuran → HCID 20222937, compound
Reaction equation
[Cl:1][c:2]1[cH:3][c:4]([CH2:9][NH:10][c:11]2[c:12]([NH2:17])[cH:13][cH:14][cH:15][cH:16]2)[cH:5][cH:6][c:7]1[Cl:8].[F:18][c:19]1[cH:20][cH:21][c:22]([CH2:25][n:26]2[c:27]([NH:35][CH:36]3[CH2:37][CH2:38][N:39]([CH2:42][CH2:43][N:44]=[C:45]=[S:46])[CH2:40][CH2:41]3)[n:28][c:29]3[c:30]2[cH:31][cH:32][cH:33][cH:34]3)[cH:23][cH:24]1.[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1>>[Cl:1][c:2]1[cH:3][c:4]([CH2:9][NH:10][c:11]2[c:12]([NH:17][C:45]([NH:44][CH2:43][CH2:42][N:39]3[CH2:38][CH2:37][CH:36]([NH:35][c:27]4[n:26]([CH2:25][c:22]5[cH:21][cH:20][c:19]([F:18])[cH:24][cH:23]5)[c:30]5[c:29]([n:28]4)[cH:34][cH:33][cH:32][cH:31]5)[CH2:41][CH2:40]3)=[S:46])[cH:13][cH:14][cH:15][cH:16]2)[cH:5][cH:6][c:7]1[Cl:8]Participants
4
Sources & evidence
- ORD record
- ord-b67bb567947f4eebb9420de92c80d32b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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