Bromide ion → HCID 58063612, compound

HRID 2324276Notes

Reaction equation

HRID 2324276 reaction equation
[Br-:39].[CH2:1]([CH3:2])[c:3]1[n:4][cH:5][cH:6][c:7](-[c:9]2[c:10]([O:37][CH3:38])[cH:11][c:12](-[c:15]3[n:16][n:17][n:18]([CH:20]4[C:21](=[O:36])[N:22]([CH2:31][C:32]([F:33])([F:34])[F:35])[c:23]5[c:24]([cH:27][cH:28][cH:29][cH:30]5)[CH2:25][CH2:26]4)[cH:19]3)[cH:13][cH:14]2)[cH:8]1.[CH:40]([Mg+:41])([CH3:42])[CH3:43].[Cl:44][c:45]1[cH:46][c:47](-[c:48]2[cH:49][cH:50][c:51](-[c:52]3[n:53][n:54][n:55]([CH:56]4[CH2:57][CH2:58][c:59]5[cH:60][cH:61][cH:62][cH:63][c:64]5[N:65]([CH2:66][C:67]([F:68])([F:69])[F:70])[C:71]4=[O:72])[cH:73]3)[cH:74][c:75]2[O:76][CH3:77])[cH:78][cH:79][n:80]1>>[CH:1]([CH3:2])([c:3]1[n:4][cH:5][cH:6][c:7](-[c:9]2[c:10]([O:37][CH3:38])[cH:11][c:12](-[c:15]3[n:16][n:17][n:18]([CH:20]4[C:21](=[O:36])[N:22]([CH2:31][C:32]([F:33])([F:34])[F:35])[c:23]5[c:24]([cH:27][cH:28][cH:29][cH:30]5)[CH2:25][CH2:26]4)[cH:19]3)[cH:13][cH:14]2)[cH:8]1)[CH3:40]

Participants

5

Reactant 4

HCID 259Bromide ionHCID 58063545HCID 58063545, compoundHCID 58063577HCID 58063577, compoundHCID 178461726HCID 178461726, compound

Product 1

HCID 58063612HCID 58063612, compound

Sources & evidence

ORD record
ord-c713ef8542e143c1bf5ef10b814b9533
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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