Diethyl Ether → 4-(4-Chloro-2-fluorophenoxy)-7-(3-(1,1-dioxothiomorpholino)propoxy)-6-methoxyquinazoline
Reaction equation
[CH2:53]([P:54]([CH2:55][CH2:56][CH2:57][CH3:58])[CH2:59][CH2:60][CH2:61][CH3:62])[CH2:63][CH2:64][CH3:65].[CH2:71]([Cl:72])[Cl:73].[CH3:66][CH2:67][O:68][CH2:69][CH3:70].[Cl:31][c:32]1[cH:33][c:34]([F:52])[c:35]([O:36][c:37]2[n:38][cH:39][n:40][c:41]3[cH:42][c:43]([OH:49])[c:44]([O:47][CH3:48])[cH:45][c:46]23)[cH:50][cH:51]1.[N:13]([C:14]([N:15]1[CH2:16][CH2:17][CH2:18][CH2:19][CH2:20]1)=[O:21])=[N:22][C:23]([N:24]1[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]1)=[O:30].[O:1]=[S:2]1(=[O:12])[CH2:3][CH2:4][N:5]([CH2:8][CH2:9][CH2:10][OH:11])[CH2:6][CH2:7]1>>[O:1]=[S:2]1(=[O:12])[CH2:3][CH2:4][N:5]([CH2:8][CH2:9][CH2:10][O:11][c:43]2[cH:42][c:41]3[n:40][cH:39][n:38][c:37]([O:36][c:35]4[c:34]([F:52])[cH:33][c:32]([Cl:31])[cH:51][cH:50]4)[c:46]3[cH:45][c:44]2[O:47][CH3:48])[CH2:6][CH2:7]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-10e6927d72cf4401b9deec9818614582
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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