9-Bromo-2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepine → ethyl 2-(4-(2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-9-yl)-1H-pyrazol-1-yl)-2-methylpropanoate

HRID 2346456Notes

Reaction equation

HRID 2346456 reaction equation
[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:23][cH:24]1)-[c:6]1[n:7]([cH:11][c:12](-[c:14]3[n:15][c:16]([CH3:22])[n:17][n:18]3[CH:19]([CH3:20])[CH3:21])[n:13]1)[CH2:8][CH2:9][O:10]2.[CH3:25][C:26]([C:27](=[O:28])[O:29][CH2:30][CH3:31])([CH3:32])[n:33]1[n:34][cH:35][c:36]([B:38]2[O:39][C:40]([CH3:41])([CH3:42])[C:43]([CH3:44])([CH3:45])[O:46]2)[cH:37]1>>[c:2]1(-[c:36]2[cH:35][n:34][n:33]([C:26]([CH3:25])([C:27](=[O:28])[O:29][CH2:30][CH3:31])[CH3:32])[cH:37]2)[cH:3][c:4]2[c:5]([cH:23][cH:24]1)-[c:6]1[n:7]([cH:11][c:12](-[c:14]3[n:15][c:16]([CH3:22])[n:17][n:18]3[CH:19]([CH3:20])[CH3:21])[n:13]1)[CH2:8][CH2:9][O:10]2

Participants

3

Reactant 2

HCID 582043229-Bromo-2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepineHCID 58204434ethyl 2-methyl-2-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazol-1-yl)propanoate

Product 1

HCID 58204648ethyl 2-(4-(2-(1-isopropyl-3-methyl-1H-1,2,4-triazol-5-yl)-5,6-dihydrobenzo[f]imidazo[1,2-d][1,4]oxazepin-9-yl)-1H-pyrazol-1-yl)-2-methylpropanoate

Sources & evidence

ORD record
ord-3a4313abb6b349588494b4fef418c31b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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