Tetrahydrofuran → HCID 67229113, compound

HRID 1205140Notes

Reaction equation

HRID 1205140 reaction equation
[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([n:9][cH:10]1)[n:11]([S:31]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)(=[O:38])=[O:39])[c:12]([C:14](=[CH:15][CH:16]1[CH2:17][CH2:18][CH2:19][CH2:20]1)[c:21]1[cH:22][cH:23][c:24]([S:27](=[O:28])(=[O:29])[CH3:30])[cH:25][cH:26]1)[cH:13]2.[CH3:41][CH2:42][CH2:43][CH2:44][N+:45]([CH2:46][CH2:47][CH2:48][CH3:49])([CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH2:56][CH3:57].[CH3:63][CH2:64][O:65][C:66](=[O:67])[CH3:68].[F-:40].[O:58]1[CH2:59][CH2:60][CH2:61][CH2:62]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[c:8]([n:9][cH:10]1)[nH:11][c:12]([C:14](=[CH:15][CH:16]1[CH2:17][CH2:18][CH2:19][CH2:20]1)[c:21]1[cH:22][cH:23][c:24]([S:27](=[O:28])(=[O:29])[CH3:30])[cH:25][cH:26]1)[cH:13]2

Participants

6

Reactant 5

HCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 16028TetrabutylammoniumHCID 28179Fluoride IonHCID 672294971-benzenesulfonyl-2-[2-cyclopentyl-1-(4-methanesulfonyl-phenyl)-vinyl]-1H-pyrrolo[2,3-b]pyridin-5-carboxylic acid methyl ester

Product 1

HCID 67229113HCID 67229113, compound

Sources & evidence

ORD record
ord-59cbb62163b14814a3edea511dcb9c54
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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