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Water → N-(2-{2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl}ethyl)-4-(methylsulfonyl)aniline

HRID 166380
Notes
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Reaction equation

HRID 166380 reaction equation
[CH2:20]1[CH2:21][CH2:22][C:23]2=[N:28][CH2:27][CH2:26][CH2:25][N:24]2[CH2:29][CH2:30]1.[CH3:43][N:44]1[CH2:45][CH2:46][CH2:47][C:48]1=[O:49].[Cl:1][c:2]1[cH:3][n:4][c:5]([N:8]2[CH2:9][CH2:10][CH:11]([CH:14]3[CH:15]([CH2:17][CH2:18][NH2:19])[CH2:16]3)[CH2:12][CH2:13]2)[n:6][cH:7]1.[F:31][c:32]1[cH:33][cH:34][c:35]([S:38](=[O:39])(=[O:40])[CH3:41])[cH:36][cH:37]1.[OH2:42]>>[Cl:1][c:2]1[cH:3][n:4][c:5]([N:8]2[CH2:9][CH2:10][CH:11]([CH:14]3[CH:15]([CH2:17][CH2:18][NH:19][c:32]4[cH:33][cH:34][c:35]([S:38](=[O:39])(=[O:40])[CH3:41])[cH:36][cH:37]4)[CH2:16]3)[CH2:12][CH2:13]2)[n:6][cH:7]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 962WaterHCID 13387N-methyl-2-pyrrolidoneHCID 679941-Fluoro-4-(methylsulphonyl)benzeneHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 669270622-{2-[1-(5-Chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl}ethanamine

Product 1

HCID 67778059
N-(2-{2-[1-(5-chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl}ethyl)-4-(methylsulfonyl)aniline

Sources & evidence

ORD record
ord-cdd1c52458b54a5a8b09724554b4526e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes