Acetonitrile → HCID 178509488, compound
Reaction equation
[CH2:31]1[CH2:32][CH2:33][C:34]2=[N:39][CH2:38][CH2:37][CH2:36][N:35]2[CH2:40][CH2:41]1.[CH3:42][C:43]#[N:44].[CH:1]1([n:4]2[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]3[cH:9][c:10]([F:16])[c:11]([F:15])[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1.[NH2:21][CH2:22][CH:23]1[CH:24]2[CH2:25][NH:26][CH2:27][CH:28]2[CH2:29][CH2:30]1>>[CH:1]1([n:4]2[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]3[cH:9][c:10]([F:16])[c:11]([N:26]4[CH2:25][CH:24]5[CH:23]([CH2:22][NH2:21])[CH2:30][CH2:29][CH:28]5[CH2:27]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1Participants
5
Sources & evidence
- ORD record
- ord-52029a69221e43289722032ef809e833
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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