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Dimethyl Sulfoxide → 2-[2-[2-[1-(5-Chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethylamino]-6-methylpyridine-4-carbonitrile

HRID 2313689
Notes
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Reaction equation

HRID 2313689 reaction equation
[CH3:36][S:37]([CH3:38])=[O:39].[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.[Cl:26][c:27]1[cH:28][c:29]([C:30]#[N:31])[cH:32][c:33]([CH3:35])[n:34]1.[K+:20].[K+:21].[O-:22][C:23]([O-:24])=[O:25].[OH2:40]>>[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:27]4[cH:28][c:29]([C:30]#[N:31])[cH:32][c:33]([CH3:35])[n:34]4)[CH2:16]3)[CH2:12][CH2:13]2)[n:6][cH:7]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 962WaterHCID 19660Carbonate IonHCID 210854392-Chloro-6-methylpyridine-4-carbonitrileHCID 669270622-{2-[1-(5-Chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl}ethanamine

Product 1

HCID 75586378
2-[2-[2-[1-(5-Chloropyrimidin-2-yl)piperidin-4-yl]cyclopropyl]ethylamino]-6-methylpyridine-4-carbonitrile

Sources & evidence

ORD record
ord-84752d1b3eec4a05888294159b79e5f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes