Water → HCID 18509279, compound

Reaction equation

[Cl:1][c:2]1[cH:3][c:4]([C:20]([NH2:21])=[O:22])[c:5]([N:6]([S:7](=[O:8])(=[O:9])[c:10]2[cH:11][cH:12][c:13]([CH3:16])[cH:14][cH:15]2)[CH3:17])[cH:18][cH:19]1.[F:23][C:24]([F:25])([F:26])[C:27]([O:28][C:29](=[O:30])[C:31]([F:32])([F:33])[F:34])=[O:35].[OH2:36].[cH:37]1[cH:38][cH:39][n:40][cH:41][cH:42]1>>[Cl:1][c:2]1[cH:3][c:4]([C:20]#[N:21])[c:5]([N:6]([S:7](=[O:8])(=[O:9])[c:10]2[cH:11][cH:12][c:13]([CH3:16])[cH:14][cH:15]2)[CH3:17])[cH:18][cH:19]1

Participants

Reactant 4

HCID 962Water

HCID 1049Pyridine

HCID 9845Trifluoroacetic anhydride

HCID 18509237HCID 18509237, compound

Product 1

HCID 18509279HCID 18509279, compound

Sources & evidence

ORD record: ord-0409efc244d94fad834ce1afcef72045
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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