Ammonia → HCID 66885284, compound
Reaction equation
[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:49][C:50]#[N:51].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[Cl:8][C:9]([O:10][CH2:11][CH:12]([CH3:13])[CH3:14])=[O:15].[NH3:48].[s:16]1[c:17]2[c:18]([cH:19][cH:20]1)[c:21]([N:25]1[CH2:26][CH2:27][N:28]([CH2:31][CH2:32][CH2:33][O:34][c:35]3[cH:36][c:37]([C:45](=[O:46])[OH:47])[n:38][c:39]4[cH:40][cH:41][cH:42][cH:43][c:44]34)[CH2:29][CH2:30]1)[cH:22][cH:23][cH:24]2>>[NH2:3][C:45]([c:37]1[cH:36][c:35]([O:34][CH2:33][CH2:32][CH2:31][N:28]2[CH2:27][CH2:26][N:25]([c:21]3[c:18]4[c:17]([s:16][cH:20][cH:19]4)[cH:24][cH:23][cH:22]3)[CH2:30][CH2:29]2)[c:44]2[c:39]([n:38]1)[cH:40][cH:41][cH:42][cH:43]2)=[O:46]Participants
7
Sources & evidence
- ORD record
- ord-94911b2a99dd4563a0c43c1436818f33
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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