Acetonitrile → HCID 67101482, compound
Reaction equation
[C:1](#[N:2])[c:3]1[c:4](-[c:9]2[n:10][c:11]([NH:40][CH2:41][CH2:42][CH:43]3[O:44][CH2:45][CH2:46][CH2:47][CH2:48]3)[c:12]([C:13](=[O:14])[NH:15][CH2:16][CH:17]3[N:18]([C:22]([CH2:23][CH2:24][CH2:25][NH:26][C:27](=[O:28])[O:29][CH2:30][c:31]4[cH:32][cH:33][cH:34][cH:35][cH:36]4)=[O:37])[CH2:19][CH2:20][CH2:21]3)[cH:38][cH:39]2)[cH:5][cH:6][cH:7][cH:8]1.[CH3:49][C:50]#[N:51]>>[C:1](#[N:2])[c:3]1[c:4](-[c:9]2[n:10][c:11]([NH:40][CH2:41][CH2:42][CH:43]3[O:44][CH2:45][CH2:46][CH2:47][CH2:48]3)[c:12]([C:13](=[O:14])[NH:15][CH2:16][CH:17]3[N:18]([C:22]([CH2:23][CH2:24][CH2:25][NH2:26])=[O:37])[CH2:19][CH2:20][CH2:21]3)[cH:38][cH:39]2)[cH:5][cH:6][cH:7][cH:8]1Participants
3
Sources & evidence
- ORD record
- ord-295996869bcd49b4b3ace191396ce63e
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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