Methanol → Benzoic acid, 4-(((5-(((4-acetyl-3-hydroxy-2-propylphenyl)methyl)thio)-1,3,4-thiadiazol-2-yl)thio)methyl)-
Reaction equation
[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:33])[c:6]([CH2:30][CH2:31][CH3:32])[c:7]([CH2:8][S:9][c:10]2[n:11][n:12][c:13]([S:15][CH2:16][c:17]3[cH:18][cH:19][c:20]([C:21](=[O:22])[O:23][CH2:24][CH3:25])[cH:26][cH:27]3)[s:14]2)[cH:28][cH:29]1.[CH3:34][OH:35].[Na+:42].[O:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1.[OH-:41].[OH2:43]>>[C:1]([CH3:2])(=[O:3])[c:4]1[c:5]([OH:33])[c:6]([CH2:30][CH2:31][CH3:32])[c:7]([CH2:8][S:9][c:10]2[n:11][n:12][c:13]([S:15][CH2:16][c:17]3[cH:18][cH:19][c:20]([C:21](=[O:22])[OH:23])[cH:26][cH:27]3)[s:14]2)[cH:28][cH:29]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-cc2f6144be014df9ac024b3a856f2300
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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