2H-Thiopyran-4-carboxylic acid, 4-aminotetrahydro-, methyl ester, 1,1-dioxide → HCID 67272137, compound
Reaction equation
[C:1](=[O:2])([OH:3])[c:4]1[cH:5][n:6][n:7]2[c:8]1[n:9][cH:10][c:11](-[c:21]1[c:22]([Cl:27])[cH:23][cH:24][cH:25][cH:26]1)[c:12]2-[c:13]1[c:14]([F:20])[cH:15][c:16]([Cl:19])[cH:17][cH:18]1.[NH2:28][C:29]1([C:37](=[O:38])[O:39][CH3:40])[CH2:30][CH2:31][S:32](=[O:35])(=[O:36])[CH2:33][CH2:34]1>>[C:1](=[O:2])([c:4]1[cH:5][n:6][n:7]2[c:8]1[n:9][cH:10][c:11](-[c:21]1[c:22]([Cl:27])[cH:23][cH:24][cH:25][cH:26]1)[c:12]2-[c:13]1[c:14]([F:20])[cH:15][c:16]([Cl:19])[cH:17][cH:18]1)[NH:28][C:29]1([C:37](=[O:38])[O:39][CH3:40])[CH2:30][CH2:31][S:32](=[O:35])(=[O:36])[CH2:33][CH2:34]1Participants
3
Sources & evidence
- ORD record
- ord-eff97059dff043928ccc7a223bbd6a15
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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