Acetic Acid → 5-Methoxy-3-(N-methylthioethyl-N-propionylamino)chroman
Reaction equation
[C:23]([BH3-:24])#[N:25].[C:29]([CH2:30][CH3:31])(=[O:32])[Cl:33].[CH3:18][S:19][CH2:20][CH2:21][NH2:22].[CH3:1][C:2](=[O:3])[OH:4].[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:41][CH2:42][OH:43].[CH3:44][OH:45].[CH3:5][O:6][c:7]1[c:8]2[c:13]([cH:14][cH:15][cH:16]1)[O:12][CH2:11][C:10](=[O:17])[CH2:9]2.[Cl:46][CH2:47][Cl:48].[Na+:26].[Na+:28].[OH-:27].[OH2:49]>>[CH3:5][O:6][c:7]1[c:8]2[c:13]([cH:14][cH:15][cH:16]1)[O:12][CH2:11][CH:10]([N:22]([CH2:21][CH2:20][S:19][CH3:18])[C:29]([CH2:30][CH3:31])=[O:32])[CH2:9]2Participants
13
Reactant 12
Product 1
Sources & evidence
- ORD record
- ord-82503cc17be4434f83f2146e86a4d477
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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