4-(2-Ethyl-thiazol-5-yl)-4-hydroxy-cyclohexanone → N-({1-[4-(2-Ethyl-thiazol-5-yl)-4-hydroxy-cyclohexyl]-azetidin-3-ylcarbamoyl}-methyl)-3-trifluoromethyl-benzamide

HRID 94364Notes

Reaction equation

HRID 94364 reaction equation
[NH:16]1[CH2:17][CH:18]([NH:20][C:21](=[O:22])[CH2:23][NH:24][C:25]([c:26]2[cH:27][c:28]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:30][cH:31]2)=[O:36])[CH2:19]1.[OH:1][C:2]1([c:9]2[cH:10][n:11][c:12]([CH2:14][CH3:15])[s:13]2)[CH2:3][CH2:4][C:5](=[O:8])[CH2:6][CH2:7]1>>[OH:1][C:2]1([c:9]2[cH:10][n:11][c:12]([CH2:14][CH3:15])[s:13]2)[CH2:3][CH2:4][CH:5]([N:16]2[CH2:17][CH:18]([NH:20][C:21](=[O:22])[CH2:23][NH:24][C:25]([c:26]3[cH:27][c:28]([C:32]([F:33])([F:34])[F:35])[cH:29][cH:30][cH:31]3)=[O:36])[CH2:19]2)[CH2:6][CH2:7]1

Participants

3

Reactant 2

HCID 593615584-(2-Ethyl-thiazol-5-yl)-4-hydroxy-cyclohexanoneHCID 59361594N-(azetidin-3-ylcarbamoylmethyl)-3-trifluoromethyl-benzamide

Product 1

HCID 46240785N-({1-[4-(2-Ethyl-thiazol-5-yl)-4-hydroxy-cyclohexyl]-azetidin-3-ylcarbamoyl}-methyl)-3-trifluoromethyl-benzamide

Sources & evidence

ORD record
ord-3badf5cc766b4466999183182fbc81a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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