Bicarbonate Ion → UC-781

HRID 159538Notes

Reaction equation

HRID 159538 reaction equation
[C:23](=[O:24])([OH:25])[O-:26].[CH3:28][O:29][c:30]1[cH:31][cH:32][c:33]([P:34]2(=[S:37])[S:35][P:36]([c:38]3[cH:39][cH:40][c:41]([O:42][CH3:43])[cH:44][cH:45]3)(=[S:46])[S:47]2)[cH:48][cH:49]1.[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Cl:1][c:2]1[c:3]([O:17][CH2:18][CH:19]=[C:20]([CH3:21])[CH3:22])[cH:4][c:5]([NH:8][C:9](=[O:10])[c:11]2[c:12]([CH3:16])[o:13][cH:14][cH:15]2)[cH:6][cH:7]1.[Na+:27]>>[Cl:1][c:2]1[c:3]([O:17][CH2:18][CH:19]=[C:20]([CH3:21])[CH3:22])[cH:4][c:5]([NH:8][C:9]([c:11]2[c:12]([CH3:16])[o:13][cH:14][cH:15]2)=[S:37])[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 1140TolueneHCID 87949Lawesson's reagentHCID 471850N-[4-chloro-3-(3-methyl-2-butenyloxy)phenyl]-2-methyl-3-furancarboxamide

Product 1

HCID 3000926UC-781

Sources & evidence

ORD record
ord-d671c9f01b294dda862ba084b1fb6239
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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