4-Methylpiperidine-4-carboxylic acid → 1-{5-[1-(4-Chloro-2-trifluoromethyl-benzyl)-1H-indazol-5-ylmethylene]-4-oxo-4,5-dihydro-thiazol-2-yl}-4-methyl-piperidine-4-carboxylic acid

HRID 1557631Notes

Reaction equation

HRID 1557631 reaction equation
[CH3:32][C:33]1([C:39](=[O:40])[OH:41])[CH2:34][CH2:35][NH:36][CH2:37][CH2:38]1.[Cl:1][c:2]1[cH:3][c:4]([C:28]([F:29])([F:30])[F:31])[c:5]([CH2:6][n:7]2[n:8][cH:9][c:10]3[cH:11][c:12]([CH:16]=[C:17]4[C:18](=[O:25])[N:19]=[C:20]([S:22][CH2:23][CH3:24])[S:21]4)[cH:13][cH:14][c:15]23)[cH:26][cH:27]1>>[Cl:1][c:2]1[cH:3][c:4]([C:28]([F:29])([F:30])[F:31])[c:5]([CH2:6][n:7]2[n:8][cH:9][c:10]3[cH:11][c:12]([CH:16]=[C:17]4[C:18](=[O:25])[N:19]=[C:20]([N:36]5[CH2:35][CH2:34][C:33]([CH3:32])([C:39](=[O:40])[OH:41])[CH2:38][CH2:37]5)[S:21]4)[cH:13][cH:14][c:15]23)[cH:26][cH:27]1

Participants

3

Reactant 2

HCID 221045794-Methylpiperidine-4-carboxylic acidHCID 672401235-[1-(4-chloro-2-trifluoromethyl-benzyl)-1H-indazol-5-ylmethylene]-2-ethylsulfanyl-thiazol-4-one

Product 1

HCID 672431631-{5-[1-(4-Chloro-2-trifluoromethyl-benzyl)-1H-indazol-5-ylmethylene]-4-oxo-4,5-dihydro-thiazol-2-yl}-4-methyl-piperidine-4-carboxylic acid

Sources & evidence

ORD record
ord-1def63bb6f534b9899a3a584f20d8e91
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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