Water → HCID 59333598, compound
Reaction equation
[CH3:1][N:2]1[CH2:3][CH2:4][CH2:5][C:6]1=[O:7].[Cl:8][c:9]1[n:10]([CH2:32][CH:33]2[CH2:34][CH2:35]2)[c:11]2[n:12][c:13](-[c:24]3[c:25]([CH3:31])[n:26][c:27]([NH2:30])[n:28][cH:29]3)[n:14][c:15]([N:18]3[CH2:19][CH2:20][O:21][CH2:22][CH2:23]3)[c:16]2[n:17]1.[NH:36]1[CH2:37][CH2:38][CH:39]([C:40](=[O:41])[NH2:42])[CH2:43][CH2:44]1.[OH2:45]>>[c:9]1([N:36]2[CH2:37][CH2:38][CH:39]([C:40](=[O:41])[NH2:42])[CH2:43][CH2:44]2)[n:10]([CH2:32][CH:33]2[CH2:34][CH2:35]2)[c:11]2[n:12][c:13](-[c:24]3[c:25]([CH3:31])[n:26][c:27]([NH2:30])[n:28][cH:29]3)[n:14][c:15]([N:18]3[CH2:19][CH2:20][O:21][CH2:22][CH2:23]3)[c:16]2[n:17]1Participants
5
Sources & evidence
- ORD record
- ord-6aedf782e67443ee9f9adb617be60374
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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