Benzene → HCID 23659326, compound
Reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12])[S:13][c:14]1[n:15][n:16][c:17]([SH:19])[s:18]1.[Cl:22][c:23]1[c:24]([C:29]#[N:30])[n:25][cH:26][cH:27][n:28]1.[H-:21].[Na+:20].[O:31]=[CH:32][N:33]([CH3:34])[CH3:35].[cH:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH3:12])[S:13][c:14]1[n:15][n:16][c:17]([S:19][c:23]2[c:24]([C:29]#[N:30])[n:25][cH:26][cH:27][n:28]2)[s:18]1Participants
7
Sources & evidence
- ORD record
- ord-15178774993e4a93936d15f9daa1ee93
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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