Water → N-(4-{4-[8-(1-hydroxy-1-methyl-ethyl)-imidazo[1,2-a]pyridine-3-yl]-pyrimidin-2-ylamino}-cyclohexyl)-methanesulfonamide

HRID 291646

Reaction equation

HRID 291646 reaction equation
[CH3:1][S:2](=[O:3])[c:4]1[n:5][cH:6][cH:7][c:8](-[c:10]2[cH:11][n:12][c:13]3[n:14]2[cH:15][cH:16][cH:17][c:18]3[C:19]([CH3:20])([CH3:21])[OH:22])[n:9]1.[CH3:35][N:36]1[CH2:37][CH2:38][CH2:39][C:40]1=[O:41].[NH2:23][CH:24]1[CH2:25][CH2:26][CH:27]([NH:30][S:31](=[O:32])(=[O:33])[CH3:34])[CH2:28][CH2:29]1.[OH2:42]>>[c:4]1([NH:23][CH:24]2[CH2:25][CH2:26][CH:27]([NH:30][S:31](=[O:32])(=[O:33])[CH3:34])[CH2:28][CH2:29]2)[n:5][cH:6][cH:7][c:8](-[c:10]2[cH:11][n:12][c:13]3[n:14]2[cH:15][cH:16][cH:17][c:18]3[C:19]([CH3:20])([CH3:21])[OH:22])[n:9]1

Participants

5

Reactant 4

HCID 962WaterHCID 13387N-methyl-2-pyrrolidoneHCID 18348422N-(4-aminocyclohexyl)methanesulfonamideHCID 666162852-[3-(2-Methylsulfinyl-pyrimidin-4-yl)-imidazo[1,2-a]pyridin-8-yl]-propan-2-ol

Product 1

HCID 46896571N-(4-{4-[8-(1-hydroxy-1-methyl-ethyl)-imidazo[1,2-a]pyridine-3-yl]-pyrimidin-2-ylamino}-cyclohexyl)-methanesulfonamide

Sources & evidence

ORD record
ord-330f0ec01bc04264afe68d275a66f420
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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