HCID 68522041, compound → HCID 86612410, compound

HRID 179574Notes

Reaction equation

HRID 179574 reaction equation
[CH2:25]([CH3:26])[O:27][C:28](=[O:29])[c:30]1[s:31][c:32]([S:44]([CH3:45])(=[O:46])=[O:47])[c:33]([C:42]#[N:43])[c:34]1-[c:35]1[cH:36][cH:37][c:38]([I:41])[cH:39][cH:40]1.[CH3:1][O:2][C:3]([c:4]1[s:5][c:6]([N:22]=[N+:23]=[N-:24])[c:7]([C:8]#[N:9])[c:10]1-[c:11]1[cH:12][cH:13][cH:14][cH:15][c:16]1[C:17]([CH3:18])([CH3:19])[CH3:20])=[O:21]>>[N:22](=[N+:23]=[N-:24])[c:32]1[s:31][c:30]([C:28]([O:27][CH2:25][CH3:26])=[O:29])[c:34](-[c:35]2[cH:36][cH:37][c:38]([I:41])[cH:39][cH:40]2)[c:33]1[C:42]#[N:43]

Participants

3

Sources & evidence

ORD record
ord-9826341923074d0aa8dcda456086bc84
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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