Dimethylformamide → Ethyl 2-(6-(5-carbamoyl-1,3,4-thiadiazol-2-yloxy)-1-hydroxy-4-methyl-1,3-dihydrobenzo[c][1,2]oxaborol-3-yl)acetate

HRID 2334148Notes

Reaction equation

HRID 2334148 reaction equation
[C:19](=[O:20])([O-:21])[O-:22].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH:6]1[c:7]2[c:8]([cH:12][c:13]([OH:17])[cH:14][c:15]2[CH3:16])[B:9]([OH:11])[O:10]1)=[O:18].[Cl:25][c:26]1[n:27][n:28][c:29]([C:31](=[O:32])[NH2:33])[s:30]1.[Cs+:23].[Cs+:24].[O:34]=[CH:35][N:36]([CH3:37])[CH3:38]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][CH:6]1[c:7]2[c:8]([cH:12][c:13]([O:17][c:26]3[n:27][n:28][c:29]([C:31](=[O:32])[NH2:33])[s:30]3)[cH:14][c:15]2[CH3:16])[B:9]([OH:11])[O:10]1)=[O:18]

Participants

6

Reactant 5

HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 123487555-Chloro-1,3,4-thiadiazole-2-carboxamideHCID 58292549Ethyl 2-(1,6-dihydroxy-4-methyl-1,3-dihydrobenzo[c][1,2]oxaborol-3-yl)acetate

Product 1

HCID 58292581Ethyl 2-(6-(5-carbamoyl-1,3,4-thiadiazol-2-yloxy)-1-hydroxy-4-methyl-1,3-dihydrobenzo[c][1,2]oxaborol-3-yl)acetate

Sources & evidence

ORD record
ord-c639e49cf4424fa19e2e95930e9b22e1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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