HCID 21972006, compound → HCID 54278067, compound

HRID 1212827Notes

Reaction equation

HRID 1212827 reaction equation
[NH2:30][CH2:31][CH2:32][CH2:33][CH2:34][N:35]([CH2:36][CH2:37][OH:38])[CH2:39][CH2:40][OH:41].[c:1]1([O:2][C:8]([NH:9][c:10]2[c:11]([C:26]([NH2:27])=[O:28])[c:12]([O:15][CH2:16][c:17]3[c:18]([F:25])[cH:19][c:20]([CH3:24])[c:21]([F:23])[cH:22]3)[n:13][s:14]2)=[O:29])[cH:3][cH:4][cH:5][cH:6][cH:7]1>>[C:8]([NH:9][c:10]1[c:11]([C:26]([NH2:27])=[O:28])[c:12]([O:15][CH2:16][c:17]2[c:18]([F:25])[cH:19][c:20]([CH3:24])[c:21]([F:23])[cH:22]2)[n:13][s:14]1)(=[O:29])[NH:30][CH2:31][CH2:32][CH2:33][CH2:34][N:35]([CH2:36][CH2:37][OH:38])[CH2:39][CH2:40][OH:41]

Participants

3

Reactant 2

HCID 21972006HCID 21972006, compoundHCID 54330906[4-Carbamoyl-3-(2,5-difluoro-4-methyl-benzyloxy)-isothiazol-5-yl]carbamic acid phenyl ester

Product 1

HCID 54278067HCID 54278067, compound

Sources & evidence

ORD record
ord-f5153d3606f947199df25fcf04fa8603
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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