Acetic Acid → HCID 59856906, compound

HRID 294417Notes

Reaction equation

HRID 294417 reaction equation
[CH3:40][C:41](=[O:42])[OH:43].[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([O:13][c:14]2[n:15][cH:16][n:17][c:18]([O:20][c:21]3[c:22]([F:31])[cH:23][c:24]([S:27](=[O:28])(=[O:29])[CH3:30])[cH:25][cH:26]3)[cH:19]2)[CH2:11][CH2:12]1.[O:32]=[C:33]1[N:34]([Br:39])[C:35](=[O:36])[CH2:37][CH2:38]1>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5](=[O:6])[N:7]1[CH2:8][CH2:9][CH:10]([O:13][c:14]2[n:15][cH:16][n:17][c:18]([O:20][c:21]3[c:22]([F:31])[cH:23][c:24]([S:27](=[O:28])(=[O:29])[CH3:30])[cH:25][cH:26]3)[c:19]2[Br:39])[CH2:11][CH2:12]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 67184N-bromobutanimideHCID 54584625HCID 54584625, compound

Product 1

HCID 59856906HCID 59856906, compound

Sources & evidence

ORD record
ord-62c57ad317eb4354a36040f63bd2c01b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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