Acetic Acid → 4-[5-(Azetidine-1-carbonyl)-pyrazin-2-yloxy]-2,2-dimethyl-2,3-dihydro-benzofuran-6-carboxylic acid (1-methyl-1H-pyrazol-3-yl)-amide

HRID 1230640Notes

Reaction equation

HRID 1230640 reaction equation
[C:36]([OH:37])(=[O:38])[CH3:39].[CH2:32]1[CH2:33][NH:34][CH2:35]1.[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6][cH:7][c:8]([O:11][c:12]2[cH:13][c:14]([C:23]([NH:24][c:25]3[n:26][n:27]([CH3:30])[cH:28][cH:29]3)=[O:31])[cH:15][c:16]3[c:17]2[CH2:18][C:19]([CH3:21])([CH3:22])[O:20]3)[n:9][cH:10]1>>[C:3](=[O:4])([c:5]1[n:6][cH:7][c:8]([O:11][c:12]2[cH:13][c:14]([C:23]([NH:24][c:25]3[n:26][n:27]([CH3:30])[cH:28][cH:29]3)=[O:31])[cH:15][c:16]3[c:17]2[CH2:18][C:19]([CH3:21])([CH3:22])[O:20]3)[n:9][cH:10]1)[N:34]1[CH2:33][CH2:32][CH2:35]1

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 10422AzetidineHCID 59560421HCID 59560421, compound

Product 1

HCID 595602204-[5-(Azetidine-1-carbonyl)-pyrazin-2-yloxy]-2,2-dimethyl-2,3-dihydro-benzofuran-6-carboxylic acid (1-methyl-1H-pyrazol-3-yl)-amide

Sources & evidence

ORD record
ord-ee4b614d6f18490d9a1be2f6c2ed84a2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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