Hydrochloric Acid → HCID 53752128, compound
Reaction equation
[CH3:27][N:28]([CH3:29])[CH:30]=[O:31].[Cl:1][C:2]([C:3]([Cl:4])=[O:5])=[O:6].[Cl:54][CH2:55][Cl:56].[ClH:32].[NH2:33][c:34]1[c:35]([OH:53])[cH:36][cH:37][c:38]([CH2:40][CH2:41][CH2:42][S:43](=[O:44])(=[O:45])[c:46]2[cH:47][cH:48][c:49]([Cl:52])[cH:50][cH:51]2)[cH:39]1.[cH:57]1[cH:58][cH:59][n:60][cH:61][cH:62]1.[s:7]1[c:8]([CH:16]=[CH:17][c:18]2[cH:19][cH:20][c:21]([C:22](=[O:23])[OH:24])[cH:25][cH:26]2)[n:9][c:10]2[c:11]1[cH:12][cH:13][cH:14][cH:15]2>>[s:7]1[c:8]([CH:16]=[CH:17][c:18]2[cH:19][cH:20][c:21]([C:22](=[O:24])[NH:33][c:34]3[c:35]([OH:53])[cH:36][cH:37][c:38]([CH2:40][CH2:41][CH2:42][S:43](=[O:44])(=[O:45])[c:46]4[cH:47][cH:48][c:49]([Cl:52])[cH:50][cH:51]4)[cH:39]3)[cH:25][cH:26]2)[n:9][c:10]2[c:11]1[cH:12][cH:13][cH:14][cH:15]2Participants
8
Sources & evidence
- ORD record
- ord-2c9dea0553e54a689c46615ad9adde67
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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