Diethyl Ether → HCID 178482071, compound

HRID 1132542Notes

Reaction equation

[CH2:50]([O:51][CH2:52][CH3:53])[CH3:54].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[n:9][c:10](-[c:21]3[cH:22][c:23]([NH:27][C:28](=[O:29])[NH:30][c:31]4[cH:32][cH:33][c:34]([C:37]([F:38])([F:39])[F:40])[cH:35][cH:36]4)[cH:24][cH:25][cH:26]3)[c:11](-[c:13]3[cH:14][c:15]([NH:19][CH3:20])[n:16][cH:17][cH:18]3)[cH:12]2)[cH:41][cH:42]1.[OH:43][C:44]([C:45]([F:46])([F:47])[F:48])=[O:49]>>[nH:8]1[n:9][c:10](-[c:21]2[cH:22][c:23]([NH:27][C:28](=[O:29])[NH:30][c:31]3[cH:32][cH:33][c:34]([C:37]([F:38])([F:39])[F:40])[cH:35][cH:36]3)[cH:24][cH:25][cH:26]2)[c:11](-[c:13]2[cH:14][c:15]([NH:19][CH3:20])[n:16][cH:17][cH:18]2)[cH:12]1

Participants

Reactant 3

HCID 3283Diethyl Ether

HCID 6422Trifluoroacetic acid

HCID 671843231-(3-{1-(4-methoxybenzyl)-4-[2-(methylamino)pyridin-4-yl]-1H-pyrazol-3-yl}phenyl)-3-[4-(trifluoromethyl)phenyl]urea

Product 1

HCID 178482071HCID 178482071, compound

Sources & evidence

ORD record: ord-5f617697cfc54c0f8b547f552ec3c616
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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