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Isopropyl 5-[acetyl-(3,5-bistrifluoromethylbenzyl)amino]-8-amino-2,3,4,5-tetrahydrobenzo[b]azepine-1-carboxylate → Isopropyl 5-[Acetyl-(3,5-bis-trifluoromethyl-benzyl)-amino]-7-amino-8-methyl-2,3,4,5-tetrahydro-benzo[b]azepine-1-carboxylate

HRID 306067
Notes
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Reaction equation

HRID 306067 reaction equation
[C:39]([N:42]([CH2:40][c:41]1[cH:43][c:44]([C:45]([F:46])([F:47])[F:48])[cH:49][c:50]([C:51]([F:52])([F:53])[F:54])[cH:55]1)[CH:56]1[CH2:57][CH2:58][CH2:59][N:60]([C:61]([O:62][CH:63]([CH3:64])[CH3:65])=[O:66])[c:67]2[cH:68][c:69]([NH2:70])[cH:71][cH:72][c:73]21)(=[O:74])[CH3:75].[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[c:8]2[c:9]([cH:33][c:34]([Br:38])[c:35]([CH3:37])[cH:36]2)[CH:10]([N:14]([CH2:15][c:16]2[cH:17][c:18]([C:26]([F:27])([F:28])[F:29])[cH:19][c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]2)[C:30]([CH3:31])=[O:32])[CH2:11][CH2:12][CH2:13]1>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[c:8]2[c:9]([cH:33][c:34]([NH2:42])[c:35]([CH3:37])[cH:36]2)[CH:10]([N:14]([CH2:15][c:16]2[cH:17][c:18]([C:26]([F:27])([F:28])[F:29])[cH:19][c:20]([C:22]([F:23])([F:24])[F:25])[cH:21]2)[C:30]([CH3:31])=[O:32])[CH2:11][CH2:12][CH2:13]1
ParticipantsSources & evidenceReaction notes

Participants

3

Reactant 2

HCID 59003104Isopropyl 5-[acetyl-(3,5-bistrifluoromethylbenzyl)amino]-8-amino-2,3,4,5-tetrahydrobenzo[b]azepine-1-carboxylateHCID 59003226Isopropyl-5-[acetyl-(3,5-bistrifluoromethylbenzyl)amino]-7-bromo-8-methyl-2,3,4,5-tetrahydrobenzo[b]azepine-1-carboxylate

Product 1

HCID 59003155Isopropyl 5-[Acetyl-(3,5-bis-trifluoromethyl-benzyl)-amino]-7-amino-8-methyl-2,3,4,5-tetrahydro-benzo[b]azepine-1-carboxylate

Sources & evidence

ORD record
ord-7f19ba69ef26448b921072ba9139be20
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes