Acetonitrile → HCID 24831677, compound
Reaction equation
[CH2:27]1[CH2:28][CH2:29][C:30]2=[N:35][CH2:34][CH2:33][CH2:32][N:31]2[CH2:36][CH2:37]1.[CH3:38][C:39]#[N:40].[Cl:1][c:2]1[n:3][c:4]2[c:5]([O:12][CH:13]3[CH2:14][CH2:15][O:16][CH2:17][CH2:18]3)[cH:6][cH:7][cH:8][c:9]2[cH:10][n:11]1.[NH2:19][CH:20]1[CH2:21][CH2:22][CH:23]([OH:26])[CH2:24][CH2:25]1>>[c:2]1([NH:19][CH:20]2[CH2:21][CH2:22][CH:23]([OH:26])[CH2:24][CH2:25]2)[n:3][c:4]2[c:5]([O:12][CH:13]3[CH2:14][CH2:15][O:16][CH2:17][CH2:18]3)[cH:6][cH:7][cH:8][c:9]2[cH:10][n:11]1Participants
5
Sources & evidence
- ORD record
- ord-e5434cd6c7824b6b92dfe05717cdb8a1
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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