Propanal → HCID 66754902, compound
Reaction equation
[CH2:48]1[O:49][CH2:50][CH2:51][CH2:52]1.[CH:44]([CH2:45][CH3:46])=[O:47].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([n:6]([S:31](=[O:32])(=[O:33])[c:34]3[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]3)[c:7](=[O:30])[n:8]2[CH:9]([C:10]([N:11]2[CH2:12][CH2:13][N:14]([CH:17]3[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]3)[CH2:15][CH2:16]2)=[O:23])[c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[cH:42][cH:43]1>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([n:6]([S:31](=[O:32])(=[O:33])[c:34]3[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]3)[c:7](=[O:30])[n:8]2[CH:9]([C:10]([N:11]2[CH2:12][CH2:13][N:14]([CH:17]3[CH2:18][CH2:19][N:20]([CH2:44][CH2:45][CH3:46])[CH2:21][CH2:22]3)[CH2:15][CH2:16]2)=[O:23])[c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[cH:42][cH:43]1Participants
4
Sources & evidence
- ORD record
- ord-db9399e109e54f24bd4ad3aef770695a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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