Isopropanol → HCID 25185035, compound
Reaction equation
[CH:31]([OH:32])([CH3:33])[CH3:34].[Cl:1][c:2]1[n:3][cH:4][c:5]([F:19])[c:6]([NH:8][c:9]2[cH:10][cH:11][c:12]([CH2:15][CH2:16][CH2:17][F:18])[cH:13][cH:14]2)[n:7]1.[F:35][C:36]([F:37])([F:38])[C:39]([OH:40])=[O:41].[NH2:20][c:21]1[cH:22][cH:23][c:24]([S:27]([NH2:28])(=[O:29])=[O:30])[cH:25][cH:26]1>>[c:2]1([NH:20][c:21]2[cH:22][cH:23][c:24]([S:27]([NH2:28])(=[O:29])=[O:30])[cH:25][cH:26]2)[n:3][cH:4][c:5]([F:19])[c:6]([NH:8][c:9]2[cH:10][cH:11][c:12]([CH2:15][CH2:16][CH2:17][F:18])[cH:13][cH:14]2)[n:7]1Participants
5
Sources & evidence
- ORD record
- ord-f3a355f94c4d4f8b86d103659a702405
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)