Acetic Acid → trans-N2-{4-[(4-bromo-2-trifluoromethoxy-benzylamino)-methyl]-cyclohexylmethyl}-N4,N4-dimethyl-quinazoline-2,4-diamine
Reaction equation
[Br:24][c:25]1[cH:26][c:27]([O:33][C:34]([F:35])([F:36])[F:37])[c:28]([CH:29]=[O:30])[cH:31][cH:32]1.[CH3:38][C:39](=[O:40])[OH:41].[Cl:42][CH2:43][Cl:44].[NH2:1][CH2:2][CH:3]1[CH2:4][CH2:5][CH:6]([CH2:9][NH:10][c:11]2[n:12][c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]3[c:19]([N:21]([CH3:22])[CH3:23])[n:20]2)[CH2:7][CH2:8]1>>[NH:1]([CH2:2][CH:3]1[CH2:4][CH2:5][CH:6]([CH2:9][NH:10][c:11]2[n:12][c:13]3[cH:14][cH:15][cH:16][cH:17][c:18]3[c:19]([N:21]([CH3:22])[CH3:23])[n:20]2)[CH2:7][CH2:8]1)[CH2:29][c:28]1[c:27]([O:33][C:34]([F:35])([F:36])[F:37])[cH:26][c:25]([Br:24])[cH:32][cH:31]1Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-6b18550b370a4093af6852bd5de591fd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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