Potassium Cation → 1-(benzenesulfonyl)-2-ethynyl-1H-pyrrolo[2,3-b]pyridine

HRID 1230586Notes

Reaction equation

[C:1](=[O:2])([O-:3])[O-:4].[CH3:40][OH:41].[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[K+:5].[K+:6].[N+:27](=[C:29]([P:28](=[O:30])([O:31][CH3:32])[O:33][CH3:34])[C:35](=[O:36])[CH3:37])=[N-:38].[OH2:39].[c:7]1([S:13](=[O:14])(=[O:15])[n:16]2[c:17]([CH:25]=[O:26])[cH:18][c:19]3[c:20]2[n:21][cH:22][cH:23][cH:24]3)[cH:8][cH:9][cH:10][cH:11][cH:12]1>>[c:7]1([S:13](=[O:14])(=[O:15])[n:16]2[c:17]([C:25]#[CH:29])[cH:18][c:19]3[c:20]2[n:21][cH:22][cH:23][cH:24]3)[cH:8][cH:9][cH:10][cH:11][cH:12]1

Participants

Reactant 7

HCID 813Potassium Cation2×

HCID 887Methanol

HCID 962Water

HCID 8857Ethyl Acetate

HCID 19660Carbonate Ion

HCID 566921991-(Phenylsulfonyl)-1H-pyrrolo(2,3-b)pyridine-2-carboxaldehyde

HCID 136023029(1E)-1-diazo-1-dimethoxyphosphorylpropan-2-one

Product 1

HCID 730135321-(benzenesulfonyl)-2-ethynyl-1H-pyrrolo[2,3-b]pyridine

Sources & evidence

ORD record: ord-a6350e88b11a4e4ba64002d48d55437d
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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