HCID 21952613, compound → HCID 178494168, compound

HRID 1138556Notes

Reaction equation

HRID 1138556 reaction equation
[Br:53][c:54]1[c:55]([O:61][CH3:62])[n:56][cH:57][c:58]([CH3:60])[cH:59]1.[CH3:1][N:2]1[c:3]2[c:4]([C:5]([F:6])([F:7])[F:8])[cH:9][c:10]([NH:11][c:12]3[cH:13][n:14][cH:15][cH:16][cH:17]3)[cH:18][c:19]2[CH:20]2[CH2:21][NH:22][CH2:23][CH2:24][CH:25]12.[CH3:26][N:27]1[CH:28]2[CH:29]([c:30]3[cH:31][c:32]([NH:38][c:39]4[cH:40][n:41][cH:42][cH:43][c:44]4[C:45]([F:46])([F:47])[F:48])[cH:33][c:34]([C:36]#[N:37])[c:35]31)[CH2:49][NH:50][CH2:51][CH2:52]2>>[CH3:26][N:27]1[CH:28]2[CH:29]([c:30]3[cH:31][c:32]([NH:38][c:54]4[c:55]([O:61][CH3:62])[n:56][cH:57][c:58]([CH3:60])[cH:59]4)[cH:33][c:34]([C:36]#[N:37])[c:35]31)[CH2:49][NH:50][CH2:51][CH2:52]2

Participants

4

Sources & evidence

ORD record
ord-e59802e053fc49948c3699d894f3e836
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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