Water → HCID 11280075, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9](-[c:13]2[cH:14][c:15]3[c:16]([cH:24][cH:25]2)[NH:17][C:18](=[O:23])[O:19][C:20]3([CH3:21])[CH3:22])[cH:10][cH:11][cH:12]1.[CH2:40]1[O:41][CH2:42][CH2:43][CH2:44]1.[Cl:29][S:30]([Cl:31])(=[O:32])=[O:33].[N-:26]=[C:27]=[O:28].[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[OH2:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[n:8]1[c:9](-[c:13]2[cH:14][c:15]3[c:16]([cH:24][cH:25]2)[NH:17][C:18](=[O:23])[O:19][C:20]3([CH3:21])[CH3:22])[cH:10][cH:11][c:12]1[C:27]#[N:26]Participants
7
Sources & evidence
- ORD record
- ord-95241ed4f3f3401f9b5dd2403bf4caa7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
Loading…