3-Pentanamine → Ethyl 4-cyano-3-(pentan-3-ylamino)benzoate
Reaction equation
[Br:1][c:2]1[cH:3][c:4]([C:5](=[O:6])[O:7][CH2:8][CH3:9])[cH:10][cH:11][c:12]1[C:13]#[N:14].[C:15](=[O:16])([O-:17])[O-:18].[CH3:21][CH2:22][CH:23]([CH2:24][CH3:25])[NH2:26].[Cs+:19].[Cs+:20].[O:29]=[C:30]([CH:31]=[CH:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)[CH:39]=[CH:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1.[O:47]=[C:48]([CH:49]=[CH:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1)[CH:57]=[CH:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1.[O:65]=[C:66]([CH:67]=[CH:68][c:69]1[cH:70][cH:71][cH:72][cH:73][cH:74]1)[CH:75]=[CH:76][c:77]1[cH:78][cH:79][cH:80][cH:81][cH:82]1.[O:83]1[CH2:84][CH2:85][O:86][CH2:87][CH2:88]1.[Pd:27].[Pd:28]>>[c:2]1([NH:26][CH:23]([CH2:22][CH3:21])[CH2:24][CH3:25])[cH:3][c:4]([C:5](=[O:6])[O:7][CH2:8][CH3:9])[cH:10][cH:11][c:12]1[C:13]#[N:14]Participants
8
Sources & evidence
- ORD record
- ord-121d6c4bcb804b6db6acb96de1b50e7a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
Loading…