Acetonitrile → 3-(5-{7-[bis-(9,9-dibutyl-9H-fluoren-2-yl)amino]-9,9-dibutyl-9H-fluoren-2-yl}-thiophen-2-yl)-2-cyano-acrylic acid
Reaction equation
[C:72](#[N:73])[CH2:74][C:75](=[O:76])[OH:77].[CH2:1]([CH2:2][CH2:3][CH3:4])[C:5]1([CH2:68][CH2:69][CH2:70][CH3:71])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2-[c:12]2[cH:13][cH:14][c:15]([N:18]([c:19]3[cH:20][cH:21][c:22]4[c:30]([cH:31]3)[C:29]([CH2:32][CH2:33][CH2:34][CH3:35])([CH2:36][CH2:37][CH2:38][CH3:39])[c:28]3[c:23]-4[cH:24][cH:25][c:26](-[c:40]4[cH:41][cH:42][c:43]([CH:45]=[O:46])[s:44]4)[cH:27]3)[c:47]3[cH:48][c:49]4[c:57]([cH:58][cH:59]3)-[c:56]3[c:51]([cH:52][cH:53][cH:54][cH:55]3)[C:50]4([CH2:60][CH2:61][CH2:62][CH3:63])[CH2:64][CH2:65][CH2:66][CH3:67])[cH:16][c:17]21.[CH2:81]1[CH2:82][CH2:83][NH:84][CH2:85][CH2:86]1.[CH3:78][C:79]#[N:80]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[C:5]1([CH2:68][CH2:69][CH2:70][CH3:71])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2-[c:12]2[cH:13][cH:14][c:15]([N:18]([c:19]3[cH:20][cH:21][c:22]4[c:30]([cH:31]3)[C:29]([CH2:32][CH2:33][CH2:34][CH3:35])([CH2:36][CH2:37][CH2:38][CH3:39])[c:28]3[c:23]-4[cH:24][cH:25][c:26](-[c:40]4[cH:41][cH:42][c:43]([CH:45]=[C:74]([C:72]#[N:73])[C:75](=[O:76])[OH:77])[s:44]4)[cH:27]3)[c:47]3[cH:48][c:49]4[c:57]([cH:58][cH:59]3)-[c:56]3[c:51]([cH:52][cH:53][cH:54][cH:55]3)[C:50]4([CH2:60][CH2:61][CH2:62][CH3:63])[CH2:64][CH2:65][CH2:66][CH3:67])[cH:16][c:17]21Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-719da5efa2104104b84158d6f4f307f2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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