Toluene → HCID 11021991, compound
Reaction equation
[Br:13][c:14]1[cH:15][cH:16][c:17](-[c:19]2[cH:20][c:21]([C:22]#[N:23])[cH:24][cH:25][cH:26]2)[o:18]1.[CH3:1][Sn:2]([c:3]1[n:4][cH:5][c:6]([C:9]#[N:10])[cH:7][cH:8]1)([CH3:11])[CH3:12].[CH3:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[cH:34]1[cH:35][cH:36][c:37]([P:38]([Pd:39]([P:40]([c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)([P:59]([c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[P:78]([c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)[c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)([c:97]2[cH:98][cH:99][cH:100][cH:101][cH:102]2)[c:103]2[cH:104][cH:105][cH:106][cH:107][cH:108]2)[cH:109][cH:110]1>>[c:3]1(-[c:14]2[cH:15][cH:16][c:17](-[c:19]3[cH:20][c:21]([C:22]#[N:23])[cH:24][cH:25][cH:26]3)[o:18]2)[n:4][cH:5][c:6]([C:9]#[N:10])[cH:7][cH:8]1Participants
5
Sources & evidence
- ORD record
- ord-7ff1afd1ff2846e0903526338c3d3807
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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