Acetonitrile → 5-Methyl-4-nitro-thiophene-2-carboxylic acid benzyl ester
Reaction equation
[CH3:1][c:2]1[c:3]([N+:10](=[O:11])[O-:12])[cH:4][c:5]([C:7](=[O:8])[OH:9])[s:6]1.[CH3:30][C:31]#[N:32].[CH:13]([NH:14][C:15](=[N:16][CH:17]([CH3:18])[CH3:26])[O:27][CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)([CH3:28])[CH3:29]>>[CH3:1][c:2]1[c:3]([N+:10](=[O:11])[O-:12])[cH:4][c:5]([C:7]([O:8][CH2:19][c:20]2[cH:21][cH:22][cH:23][cH:24][cH:25]2)=[O:9])[s:6]1Participants
4
Sources & evidence
- ORD record
- ord-081640024d95419ebca7bf5beddd8127
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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