4-Hydroxybenzaldehyde → HCID 86651919, compound
Reaction equation
[CH2:10]([CH3:11])[O:12][C:13](=[S:14])[S:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][O:26][c:27]1[cH:28][cH:29][c:30]([C:31](=[O:32])[OH:33])[cH:34][cH:35]1.[CH3:51][N:52]([c:53]1[cH:54][cH:55][n:56][cH:57][cH:58]1)[CH3:59].[CH:36]1([N:37]=[C:38]=[N:39][CH:40]2[CH2:41][CH2:42][CH2:43][CH2:44][CH2:45]2)[CH2:46][CH2:47][CH2:48][CH2:49][CH2:50]1.[Cl:60][CH2:61][Cl:62].[OH:1][c:2]1[cH:3][cH:4][c:5]([CH:6]=[O:7])[cH:8][cH:9]1>>[c:2]1([O:33][C:31]([c:30]2[cH:29][cH:28][c:27]([O:26][CH2:25][CH2:24][CH2:23][CH2:22][CH2:21][CH2:20][CH2:19][CH2:18][CH2:17][CH2:16][S:15][C:13]([O:12][CH2:10][CH3:11])=[S:14])[cH:35][cH:34]2)=[O:32])[cH:3][cH:4][c:5]([CH:6]=[O:7])[cH:8][cH:9]1Participants
6
Sources & evidence
- ORD record
- ord-5aa7bee3a8774e40b73549b077c45b4c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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