Ethanol → 2,6-Dimethyl-8-(1-propyl-butyl)-3-(1,3,5-trimethyl-1H-pyrazol-4-yl)-imidazo[1,2-b]pyridazine
Reaction equation
[C:31](=[O:32])([O-:33])[O-:34].[CH3:20][n:21]1[n:22][c:23]([CH3:30])[c:24]([B:27]([OH:28])[OH:29])[c:25]1[CH3:26].[CH3:37][O:38][CH3:39].[CH3:41][CH2:42][OH:43].[I:1][c:2]1[c:3]([CH3:19])[n:4][c:5]2[n:6]1[n:7][c:8]([CH3:18])[cH:9][c:10]2[CH:11]([CH2:12][CH2:13][CH3:14])[CH2:15][CH2:16][CH3:17].[Na+:35].[Na+:36].[OH2:40].[cH:44]1[cH:45][cH:46][c:47]([P:48]([Pd:49]([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)([c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[cH:119][cH:120]1>>[c:2]1(-[c:24]2[c:23]([CH3:30])[n:22][n:21]([CH3:20])[c:25]2[CH3:26])[c:3]([CH3:19])[n:4][c:5]2[n:6]1[n:7][c:8]([CH3:18])[cH:9][c:10]2[CH:11]([CH2:12][CH2:13][CH3:14])[CH2:15][CH2:16][CH3:17]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-eb05d0c297bd4e94b0603021175afa48
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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