Water → HCID 21114424, compound

HRID 1201080Notes

Reaction equation

HRID 1201080 reaction equation
[CH2:30]1[CH2:33][CH2:32][CH2:31][O:34]1.[CH3:36][CH2:37][O:38][C:39]([CH3:40])=[O:41].[F:1][c:2]1[c:3]([N:9]2[C:10](=[O:29])[NH:11][CH2:12][c:13]3[c:14]2[n:15][c:16]([S:27][CH3:28])[n:17][c:18]3-[c:19]2[c:20]([CH3:26])[cH:21][c:22]([F:25])[cH:23][cH:24]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1.[OH2:35]>>[F:1][c:2]1[c:3]([N:9]2[C:10](=[O:29])[NH:11][CH2:12][c:13]3[c:14]2[n:15][c:16]([S:27]([CH3:28])=[O:34])[n:17][c:18]3-[c:19]2[c:20]([CH3:26])[cH:21][c:22]([F:25])[cH:23][cH:24]2)[c:4]([F:8])[cH:5][cH:6][cH:7]1

Participants

5

Reactant 4

HCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 10201990HCID 10201990, compound

Product 1

HCID 21114424HCID 21114424, compound

Sources & evidence

ORD record
ord-9ae74e3a04df402aac25207436170f9f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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