Reaction equation
[CH3:36][O:37][c:38]1[c:39]([S:44](=[O:45])(=[O:46])[Cl:47])[cH:40][cH:41][cH:42][cH:43]1.[CH3:48][N:49]([c:50]1[cH:51][cH:52][n:53][cH:54][cH:55]1)[CH3:56].[Cl:57][CH2:58][Cl:59].[O:1]=[c:2]1[n:3]([CH:13]([C:14]([N:15]2[CH2:16][CH:17]([N:20]3[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][CH3:28])[CH2:24][CH2:25]3)[CH2:18][CH2:19]2)=[O:29])[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:4]2[c:5]([nH:6]1)[cH:7][cH:8][c:9]([C:11]#[N:12])[cH:10]2>>[O:1]=[c:2]1[n:3]([CH:13]([C:14]([N:15]2[CH2:16][CH:17]([N:20]3[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][CH3:28])[CH2:24][CH2:25]3)[CH2:18][CH2:19]2)=[O:29])[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:4]2[c:5]([n:6]1[S:44]([c:39]1[c:38]([O:37][CH3:36])[cH:43][cH:42][cH:41][cH:40]1)(=[O:45])=[O:46])[cH:7][cH:8][c:9]([C:11]#[N:12])[cH:10]2Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-6a751850ee694c338dd97a41650b4e80
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Linked notes
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