HCID 87421463, compound → HCID 44815516, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]([CH2:22][CH:23]([CH3:24])[CH3:25])[c:8](=[N:10][C:11](=[S:12])[c:13]2[c:14]([O:20][CH3:21])[cH:15][cH:16][c:17]([Cl:19])[cH:18]2)[s:9]1.[C:26](#[N:27])[NH-:28]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[n:6][n:7]([CH2:22][CH:23]([CH3:24])[CH3:25])[c:8](=[N:10][C:11]([c:13]2[c:14]([O:20][CH3:21])[cH:15][cH:16][c:17]([Cl:19])[cH:18]2)=[N:28][C:26]#[N:27])[s:9]1Participants
3
Sources & evidence
- ORD record
- ord-3edacd656a1e46fc9c0b6085ce5bf2e9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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