Bicarbonate Ion → 5-(5-{1-[4-(methylsulfonyl)phenyl]-2-(tetrahydro-2H-pyran-4-yl)ethyl}-1H-pyrrol-2-yl)-1,3,4-thiadiazole-2-carbaldehyde
Reaction equation
[C:31](=[O:32])([O-:33])[OH:34].[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([CH:11]([CH2:12][CH:13]2[CH2:14][CH2:15][O:16][CH2:17][CH2:18]2)[c:19]2[cH:20][cH:21][c:22](-[c:24]3[n:25][n:26][c:27]([CH2:29][OH:30])[s:28]3)[nH:23]2)[cH:9][cH:10]1.[CH3:36][C:37]#[N:38].[Na+:35]>>[CH3:1][S:2](=[O:3])(=[O:4])[c:5]1[cH:6][cH:7][c:8]([CH:11]([CH2:12][CH:13]2[CH2:14][CH2:15][O:16][CH2:17][CH2:18]2)[c:19]2[cH:20][cH:21][c:22](-[c:24]3[n:25][n:26][c:27]([CH:29]=[O:30])[s:28]3)[nH:23]2)[cH:9][cH:10]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-ec2674b2c5c744bda8442851c530eecc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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