Phosgene → HCID 73408727, compound
Reaction equation
[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([CH3:38])[N:9]=[C:10]([c:21]3[c:22]([O:35][CH2:36][CH3:37])[cH:23][cH:24][c:25]([S:27](=[O:28])(=[O:29])[N:30]4[CH2:31][CH2:32][CH2:33][CH2:34]4)[cH:26]3)[NH:11][C:12]2([CH3:13])[c:14]2[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:6][cH:7]1.[Cl:39][C:40]([Cl:41])=[O:42]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([CH3:38])[N:9]=[C:10]([c:21]3[c:22]([O:35][CH2:36][CH3:37])[cH:23][cH:24][c:25]([S:27](=[O:28])(=[O:29])[N:30]4[CH2:31][CH2:32][CH2:33][CH2:34]4)[cH:26]3)[N:11]([C:40]([Cl:39])=[O:42])[C:12]2([CH3:13])[c:14]2[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]2)[cH:6][cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-77b340ce360a4e37a8483c5f4bcfb42b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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