Acetic Acid → HCID 67132158, compound

HRID 1551680Notes

Reaction equation

HRID 1551680 reaction equation
[CH3:38][C:39](=[O:40])[OH:41].[CH3:3][NH:4][C:5]([CH2:6][CH2:7][CH2:8][c:9]1[cH:10][cH:11][c:12]([N:15]2[C:16]3([CH2:17][CH2:18][CH2:19]3)[C:20](=[O:36])[N:21]([c:24]3[cH:25][c:26]([C:32]([F:33])([F:34])[F:35])[c:27]([C:30]#[N:31])[cH:28][cH:29]3)[C:22]2=[S:23])[cH:13][cH:14]1)=[O:37].[OH:1][OH:2]>>[O:1]=[C:22]1[N:15]([c:12]2[cH:11][cH:10][c:9]([CH2:8][CH2:7][CH2:6][C:5]([NH:4][CH3:3])=[O:37])[cH:14][cH:13]2)[C:16]2([CH2:17][CH2:18][CH2:19]2)[C:20](=[O:36])[N:21]1[c:24]1[cH:25][c:26]([C:32]([F:33])([F:34])[F:35])[c:27]([C:30]#[N:31])[cH:28][cH:29]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 784Hydrogen PeroxideHCID 15951524HCID 15951524, compound

Product 1

HCID 67132158HCID 67132158, compound

Sources & evidence

ORD record
ord-b72ee7993aa748ffa355bcdefb5113bc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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