Water → HCID 57864723, compound
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([O:5][c:6]2[cH:7][cH:8][c:9]([CH2:11][NH:12][C:13](=[O:14])[c:15]3[cH:16][c:17]4[cH:18][cH:19][cH:20][n:21][c:22]4[cH:23][cH:24]3)[s:10]2)[cH:25][cH:26][cH:27]1.[C-:40]#[N:41].[C-:43]#[N:44].[CH3:28][CH2:29][O:30][C:31](=[O:32])[CH3:33].[CH3:35][N:36]([CH3:37])[CH:38]=[O:39].[OH2:34].[Zn+2:42].[cH:45]1[cH:46][cH:47][c:48]([P:49]([Pd:50]([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[cH:120][cH:121]1>>[c:2]1([C:35]#[N:36])[cH:3][c:4]([O:5][c:6]2[cH:7][cH:8][c:9]([CH2:11][NH:12][C:13](=[O:14])[c:15]3[cH:16][c:17]4[cH:18][cH:19][cH:20][n:21][c:22]4[cH:23][cH:24]3)[s:10]2)[cH:25][cH:26][cH:27]1Participants
8
Sources & evidence
- ORD record
- ord-24dae04ea3034229b6e07f729d73073c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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