Acetic Acid → 2-Amino-4-[3-(dimethylamino)pyrrolidin-1-yl]-3-iodo-5-phenylbenzonitrile
Reaction equation
[CH3:38][C:39](=[O:40])[OH:41].[CH:32]([Cl:33])([Cl:34])[Cl:35].[I:24][N:25]1[C:26](=[O:27])[CH2:28][CH2:29][C:30]1=[O:31].[NH2:1][c:2]1[c:3]([C:22]#[N:23])[cH:4][c:5](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:6]([N:8]2[CH2:9][CH:10]([N:13]([CH3:14])[CH3:15])[CH2:11][CH2:12]2)[cH:7]1.[Na+:37].[OH-:36]>>[NH2:1][c:2]1[c:3]([C:22]#[N:23])[cH:4][c:5](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:6]([N:8]2[CH2:9][CH:10]([N:13]([CH3:14])[CH3:15])[CH2:11][CH2:12]2)[c:7]1[I:24]Participants
7
Sources & evidence
- ORD record
- ord-9c74c9167d23431381ebc50acc568c37
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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