Hydrochloric Acid → 4-Bromo-N-[4-(4-dimethylamino-quinazolin-2-ylamino)-cyclohexylmethyl]-2-trifluoromethoxy-benzenesulfonamide
Reaction equation
[Br:40][c:41]1[cH:42][c:43]([O:51][C:52]([F:53])([F:54])[F:55])[c:44]([S:47](=[O:48])(=[O:49])[Cl:50])[cH:45][cH:46]1.[C:1]([O:2][C:3](=[O:4])[NH:7][CH2:8][CH:9]1[CH2:10][CH2:11][CH:12]([NH:15][c:16]2[n:17][c:18]3[cH:19][cH:20][cH:21][cH:22][c:23]3[c:24]([N:26]([CH3:27])[CH3:28])[n:25]2)[CH2:13][CH2:14]1)([CH3:5])([CH3:6])[CH3:29].[CH3:56][CH2:57][O:58][C:59]([CH3:60])=[O:61].[CH:31]([N:32]([CH:33]([CH3:34])[CH3:35])[CH2:36][CH3:37])([CH3:38])[CH3:39].[Cl:62][CH2:63][Cl:64].[ClH:30]>>[NH:7]([CH2:8][CH:9]1[CH2:10][CH2:11][CH:12]([NH:15][c:16]2[n:17][c:18]3[cH:19][cH:20][cH:21][cH:22][c:23]3[c:24]([N:26]([CH3:27])[CH3:28])[n:25]2)[CH2:13][CH2:14]1)[S:47]([c:44]1[c:43]([O:51][C:52]([F:53])([F:54])[F:55])[cH:42][c:41]([Br:40])[cH:46][cH:45]1)(=[O:48])=[O:49]Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-8decf6ac66b540709a7fb0a8981a08ab
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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