Methanol → N-(4-Cyanomethyl-phenyl)-4-(4-methoxy-phenylsulfanyl)-3-(pyrido[2,3-d]pyrimidin-4-ylamino)-benzamide
Reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([S:9][c:10]2[c:11]([NH:19][c:20]3[c:21]4[c:22]([n:23][cH:24][n:25]3)[n:26][cH:27][cH:28][cH:29]4)[cH:12][c:13]([C:14](=[O:15])[Cl:16])[cH:17][cH:18]2)[cH:7][cH:8]1.[CH3:81][OH:82].[CH:49]([c:50]1[cH:51][cH:52][c:53]2[c:54]([NH:55][c:56]3[cH:57][c:58]([C:71]([Cl:72])=[O:73])[cH:59][cH:60][c:61]3[S:62][c:63]3[cH:64][cH:65][c:66]([O:67][CH3:68])[cH:69][cH:70]3)[n:74][cH:75][n:76][c:77]2[n:78]1)([CH3:79])[CH3:80].[NH2:30][c:31]1[cH:32][cH:33][c:34]([CH2:35][C:36]#[N:37])[cH:38][cH:39]1.[NH2:40][c:41]1[cH:42][c:43]([OH:44])[c:45]([CH3:46])[cH:47][cH:48]1>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([S:9][c:10]2[c:11]([NH:19][c:20]3[c:21]4[c:22]([n:23][cH:24][n:25]3)[n:26][cH:27][cH:28][cH:29]4)[cH:12][c:13]([C:14](=[O:15])[NH:30][c:31]3[cH:32][cH:33][c:34]([CH2:35][C:36]#[N:37])[cH:38][cH:39]3)[cH:17][cH:18]2)[cH:7][cH:8]1Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-f29f67f698064e3684e50497ff46095d
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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