Diethylamine → [2-Chloro-4-(2,4-difluoro-phenylamino)-phenyl]-{5-[4-(2-diethylamino-ethyl)-[1,2,3]triazol-1-yl]-2-methyl-phenyl}-methanone

HRID 2136216Notes

Reaction equation

HRID 2136216 reaction equation
[CH2:82]([NH:83][CH2:84][CH3:85])[CH3:86].[Cl:1][c:2]1[c:3]([C:17](=[O:18])[c:19]2[c:20]([CH3:38])[cH:21][cH:22][c:23](-[n:25]3[n:26][n:27][c:28]([CH2:30][CH2:31][N:32]4[CH2:33][CH2:34][O:35][CH2:36][CH2:37]4)[cH:29]3)[cH:24]2)[cH:4][cH:5][c:6]([NH:8][c:9]2[c:10]([F:16])[cH:11][c:12]([F:15])[cH:13][cH:14]2)[cH:7]1.[Cl:39][c:40]1[cH:41][c:42]([NH:43][c:44]2[cH:45][cH:46][c:47]([F:48])[cH:49][c:50]2[F:51])[cH:52][cH:53][c:54]1[C:55]([c:56]1[cH:57][c:58](-[n:59]2[cH:60][c:61]([CH2:62][CH2:63][O:64][S:65]([c:66]3[cH:67][cH:68][c:69]([CH3:70])[cH:71][cH:72]3)(=[O:73])=[O:74])[n:75][n:76]2)[cH:77][cH:78][c:79]1[CH3:80])=[O:81]>>[Cl:1][c:2]1[c:3]([C:17](=[O:18])[c:19]2[c:20]([CH3:38])[cH:21][cH:22][c:23](-[n:25]3[n:26][n:27][c:28]([CH2:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:37][CH3:36])[cH:29]3)[cH:24]2)[cH:4][cH:5][c:6]([NH:8][c:9]2[c:10]([F:16])[cH:11][c:12]([F:15])[cH:13][cH:14]2)[cH:7]1

Participants

4

Reactant 3

HCID 8021DiethylamineHCID 11692340[2-Chloro-4-(2,4-difluoro-phenylamino)-phenyl]-{2-methyl-5-[4-(2-morpholin-4-yl-ethyl)-[1,2,3]triazol-1-yl]-phenyl}-methanoneHCID 86605530Toluene-4-sulfonic acid 2-(1-{3-[2-chloro-4-(2,4-difluoro-phenylamino)-benzoyl]-4-methyl-phenyl}-1H-[1,2,3]triazol-4-yl)-ethyl ester

Product 1

HCID 11692166[2-Chloro-4-(2,4-difluoro-phenylamino)-phenyl]-{5-[4-(2-diethylamino-ethyl)-[1,2,3]triazol-1-yl]-2-methyl-phenyl}-methanone

Sources & evidence

ORD record
ord-7b9ef0040b694d24898fb6ff38cfdc26
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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