Dimethyl Sulfoxide → HCID 44129341, compound
Reaction equation
[CH2:43]([OH:44])[CH2:45][CH3:46].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:47][S:48]([CH3:49])=[O:50].[CH3:51][CH2:52][O:53][C:54]([CH3:55])=[O:56].[CH3:57][CH2:58][CH2:59][CH2:60][CH2:61][CH3:62].[Cl:17][c:18]1[n:19][cH:20][n:21][c:22]2[c:23]1[nH:24][cH:25][n:26]2.[Cl:1][c:2]1[c:3]2[n:4][cH:5][n:6]([CH:11]3[O:12][CH2:13][CH2:14][CH2:15][CH2:16]3)[c:7]2[n:8][cH:9][n:10]1.[OH:27][c:28]1[c:29]([CH2:30][NH2:31])[cH:32][cH:33][cH:34][cH:35]1>>[c:2]1([NH:31][CH2:30][c:29]2[c:28]([OH:27])[cH:35][cH:34][cH:33][cH:32]2)[c:3]2[n:4][cH:5][n:6]([CH:11]3[O:12][CH2:13][CH2:14][CH2:15][CH2:16]3)[c:7]2[n:8][cH:9][n:10]1Participants
9
Sources & evidence
- ORD record
- ord-9029b2c5221c4252bb0179d6470b1a87
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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