Water → HCID 131724401, compound
Reaction equation
[C:16]([CH3:17])([CH3:18])([CH3:19])[SiH2:20][O:21][C:22]([CH:23]1[O:24][c:25]2[c:26]([c:29]([CH:34]=[CH:35][c:36]3[cH:37][cH:38][c:39]([N:42]([CH2:43][CH2:44][OH:45])[CH2:46][CH3:47])[cH:40][cH:41]3)[s:30][c:31]2[CH:32]=[O:33])[O:27][CH2:28]1)([CH3:48])[CH3:49].[C:1](#[N:2])[C:3]1=[C:7]([CH3:8])[C:6]([CH3:9])([CH3:10])[O:5][C:4]1=[C:11]([C:12]#[N:13])[C:14]#[N:15].[CH2:50]1[CH2:51][CH2:52][NH:53][CH2:54][CH2:55]1.[CH:56]([Cl:57])([Cl:58])[Cl:59].[OH2:60]>>[C:1](#[N:2])[C:3]1=[C:7]([CH:8]=[CH:32][c:31]2[c:25]3[c:26]([c:29]([CH:34]=[CH:35][c:36]4[cH:37][cH:38][c:39]([N:42]([CH2:43][CH2:44][OH:45])[CH2:46][CH3:47])[cH:40][cH:41]4)[s:30]2)[O:27][CH2:28][CH:23]([C:22]([O:21][SiH2:20][C:16]([CH3:17])([CH3:18])[CH3:19])([CH3:48])[CH3:49])[O:24]3)[C:6]([CH3:9])([CH3:10])[O:5][C:4]1=[C:11]([C:12]#[N:13])[C:14]#[N:15]Participants
6
Sources & evidence
- ORD record
- ord-1d208d64a4bb4f9497dbbcb9d6549b36
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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