Water → HCID 20453877, compound

Reaction equation

[CH3:22][C:23](=[O:24])[O:25][C:26](=[O:27])[CH3:28].[NH2:1][c:2]1[c:3]([C:20]#[N:21])[cH:4][n:5][n:6]1-[c:7]1[c:8]([Cl:19])[c:9]([Cl:18])[c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13].[OH2:29]>>[NH:1]([c:2]1[c:3]([C:20]#[N:21])[cH:4][n:5][n:6]1-[c:7]1[c:8]([Cl:19])[c:9]([Cl:18])[c:10]([C:14]([F:15])([F:16])[F:17])[cH:11][c:12]1[Cl:13])[C:23]([CH3:22])=[O:24]

Participants

Reactant 3

HCID 962Water

HCID 7918Acetic Anhydride

HCID 13122001HCID 13122001, compound

Product 1

HCID 20453877HCID 20453877, compound

Sources & evidence

ORD record: ord-72939c99cf604ff8a2d1d48253b83e3f
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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