Acetonitrile → HCID 178452353, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:14]([NH:15][c:16]2[c:17]([F:29])[cH:18][c:19](-[n:22]3[c:23](=[O:28])[cH:24][cH:25][cH:26][cH:27]3)[cH:20][cH:21]2)=[O:30])[CH2:10][CH:11]([NH2:13])[CH2:12]1.[CH3:40][C:41]#[N:42].[Cl:31][c:32]1[cH:33][cH:34][c:35]([C:37](=[O:38])[OH:39])[s:36]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH:9]([C:14]([NH:15][c:16]2[c:17]([F:29])[cH:18][c:19](-[n:22]3[c:23](=[O:28])[cH:24][cH:25][cH:26][cH:27]3)[cH:20][cH:21]2)=[O:30])[CH2:10][CH:11]([NH:13][C:37]([c:35]2[cH:34][cH:33][c:32]([Cl:31])[s:36]2)=[O:38])[CH2:12]1Participants
4
Sources & evidence
- ORD record
- ord-58a8663b72b04d81b3a176da896eca58
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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