Tetrahydrofuran → 1-Acetyl-6-(3,5-dibromobenzoyl)amino-4-phenyl-1,2,3,4-tetrahydro-2,2,4-trimethylquinoline

HRID 687256Notes

Reaction equation

HRID 687256 reaction equation
[Br:48][c:49]1[cH:50][c:51]([C:52](=[O:53])[OH:54])[cH:55][c:56]([Br:58])[cH:57]1.[C:25]([CH3:26])(=[O:27])[N:28]1[C:29]([CH3:46])([CH3:47])[CH2:30][C:31]([CH3:39])([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:32]2[cH:33][c:34]([NH2:38])[cH:35][cH:36][c:37]21.[CH:59]([N:60]([CH2:61][CH3:62])[CH:63]([CH3:64])[CH3:65])([CH3:66])[CH3:67].[O:68]1[CH2:69][CH2:70][CH2:71][CH2:72]1.[P-:1]([F:2])([F:3])([F:4])([F:5])([F:6])[F:7].[n:8]1([O:9][C:10]([N:11]([CH3:12])[CH3:13])=[N+:14]([CH3:15])[CH3:16])[c:17]2[n:18][cH:19][cH:20][cH:21][c:22]2[n:23][n:24]1>>[C:25]([CH3:26])(=[O:27])[N:28]1[C:29]([CH3:46])([CH3:47])[CH2:30][C:31]([CH3:39])([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:32]2[cH:33][c:34]([NH:38][C:52]([c:51]3[cH:50][c:49]([Br:48])[cH:57][c:56]([Br:58])[cH:55]3)=[O:53])[cH:35][cH:36][c:37]21

Participants

7

Reactant 6

HCID 8028TetrahydrofuranHCID 9886HexafluorophosphateHCID 12063Benzoic acid, 3,5-dibromo-HCID 81531DiisopropylethylamineHCID 28370841-(6-amino-2,2,4-trimethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)ethanoneHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

Product 1

HCID 179629301-Acetyl-6-(3,5-dibromobenzoyl)amino-4-phenyl-1,2,3,4-tetrahydro-2,2,4-trimethylquinoline

Sources & evidence

ORD record
ord-9f8d8e2727344362861fd9c56fb82b2b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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