Dichloromethane → HCID 6320538, compound
Reaction equation
[Cl:60][CH2:61][Cl:62].[O:12]([CH2:13][CH2:14][CH2:15][CH3:16])[CH2:17][CH2:18][O:19][c:20]1[cH:21][cH:22][c:23](-[c:26]2[cH:27][cH:28][c:29]3[c:30]([cH:59]2)[CH:31]=[C:32]([C:40](=[O:41])[NH:42][c:43]2[cH:44][cH:45][c:46]([S:49][CH2:50][c:51]4[cH:52][n:53][cH:54][n:55]4[CH2:56][CH2:57][CH3:58])[cH:47][cH:48]2)[CH2:33][CH2:34][CH2:35][N:36]3[CH2:37][CH2:38][CH3:39])[cH:24][cH:25]1.[OH:1][O:2][C:3]([c:4]1[cH:5][c:6]([Cl:7])[cH:8][cH:9][cH:10]1)=[O:11]>>[O:1]=[S:49]([c:46]1[cH:45][cH:44][c:43]([NH:42][C:40]([C:32]2=[CH:31][c:30]3[c:29]([cH:28][cH:27][c:26](-[c:23]4[cH:22][cH:21][c:20]([O:19][CH2:18][CH2:17][O:12][CH2:13][CH2:14][CH2:15][CH3:16])[cH:25][cH:24]4)[cH:59]3)[N:36]([CH2:37][CH2:38][CH3:39])[CH2:35][CH2:34][CH2:33]2)=[O:41])[cH:48][cH:47]1)[CH2:50][c:51]1[cH:52][n:53][cH:54][n:55]1[CH2:56][CH2:57][CH3:58]Participants
4
Sources & evidence
- ORD record
- ord-5453b1681e5249608ecc768af01e7fcb
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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