Trifluoroacetic acid → HCID 135829401, compound

HRID 1209259Notes

Reaction equation

HRID 1209259 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([C:36]#[N:37])[cH:11][c:12]2[c:13]([O:19][c:20]3[cH:21][c:22]([F:35])[c:23]([NH:26][C:27](=[O:28])[NH:29][c:30]4[s:31][cH:32][cH:33][n:34]4)[cH:24][cH:25]3)[cH:14][cH:15][n:16][c:17]2[cH:18]1.[F:46][C:47]([F:48])([F:49])[C:50]([OH:51])=[O:52].[c:38]1([S:39][CH3:40])[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[OH:8][c:9]1[c:10]([C:36]#[N:37])[cH:11][c:12]2[c:13]([O:19][c:20]3[cH:21][c:22]([F:35])[c:23]([NH:26][C:27](=[O:28])[NH:29][c:30]4[s:31][cH:32][cH:33][n:34]4)[cH:24][cH:25]3)[cH:14][cH:15][n:16][c:17]2[cH:18]1

Participants

4

Reactant 3

HCID 6422Trifluoroacetic acidHCID 7520ThioanisoleHCID 22936427HCID 22936427, compound

Product 1

HCID 135829401HCID 135829401, compound

Sources & evidence

ORD record
ord-a92c5366c79e49db93100e3ffa7f8873
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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