HCID 20705157, compound → HCID 86656529, compound

HRID 671618Notes

Reaction equation

HRID 671618 reaction equation
[CH3:35][O:36][CH2:37][CH:38]1[CH2:39][CH:40]([NH:44][CH3:45])[CH2:41][N:42]1[CH3:43].[F:1][C:2]([c:3]1[c:4]([CH2:5][n:6]2[n:7][cH:8][c:9]3[cH:10][c:11]([CH:15]=[C:16]4[C:17](=[O:24])[N:18]=[C:19]([S:21][CH2:22][CH3:23])[S:20]4)[cH:12][cH:13][c:14]23)[cH:25][cH:26][c:27]([C:29]([F:30])([F:31])[F:32])[cH:28]1)([F:33])[F:34]>>[F:1][C:2]([c:3]1[c:4]([CH2:5][n:6]2[n:7][cH:8][c:9]3[cH:10][c:11]([CH:15]=[C:16]4[C:17](=[O:24])[N:18]=[C:19]([N:44]([CH:40]5[CH2:39][CH:38]([CH2:37][O:36][CH3:35])[N:42]([CH3:43])[CH2:41]5)[CH3:45])[S:20]4)[cH:12][cH:13][c:14]23)[cH:25][cH:26][c:27]([C:29]([F:30])([F:31])[F:32])[cH:28]1)([F:33])[F:34]

Participants

3

Reactant 2

HCID 20705157HCID 20705157, compoundHCID 866545405-[1-(2,4-Bis-trifluoromethyl-benzyl)-1H-indazol-5-ylmethylene]-2-ethylsulfanyl-thiazol-4-one

Product 1

HCID 86656529HCID 86656529, compound

Sources & evidence

ORD record
ord-38a81bb714ca45ca8fad5d8e5e39fd37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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