Acetonitrile → HCID 178431540, compound
Reaction equation
[CH2:24]1[CH2:25][CH2:26][C:27]2=[N:32][CH2:31][CH2:30][CH2:29][N:28]2[CH2:33][CH2:34]1.[CH3:35][C:36]#[N:37].[Cl:8][c:9]1[n:10][c:11]([N:17]2[CH:18]([CH3:23])[CH2:19][O:20][CH2:21][CH2:22]2)[cH:12][c:13]([CH2:15][I:16])[n:14]1.[SH:1][c:2]1[cH:3][cH:4][n:5][cH:6][cH:7]1>>[S:1]([c:2]1[cH:3][cH:4][n:5][cH:6][cH:7]1)[CH2:15][c:13]1[cH:12][c:11]([N:17]2[CH:18]([CH3:23])[CH2:19][O:20][CH2:21][CH2:22]2)[n:10][c:9]([Cl:8])[n:14]1Participants
5
Sources & evidence
- ORD record
- ord-288615b8ca9a4cccbb6869b971333ce0
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…