Acetic Acid → HCID 67319092, compound

HRID 1564855Notes

Reaction equation

HRID 1564855 reaction equation
[CH3:1][O:2][c:3]1[c:4]([CH:5]=[CH:6][S:7](=[O:8])(=[O:9])[NH:10][c:11]2[cH:12][c:13]([NH2:19])[c:14]([O:17][CH3:18])[cH:15][cH:16]2)[c:20]([O:26][CH3:27])[cH:21][c:22]([O:24][CH3:25])[cH:23]1.[CH3:33][C:34](=[O:35])[OH:36].[K:28][O:29][C:30]#[N:31].[OH2:32]>>[CH3:1][O:2][c:3]1[c:4]([CH:5]=[CH:6][S:7](=[O:8])(=[O:9])[NH:10][c:11]2[cH:12][c:13]([NH:19][C:30](=[O:29])[NH2:31])[c:14]([O:17][CH3:18])[cH:15][cH:16]2)[c:20]([O:26][CH3:27])[cH:21][c:22]([O:24][CH3:25])[cH:23]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 66810362HCID 66810362, compoundHCID 178418250HCID 178418250, compound

Product 1

HCID 67319092HCID 67319092, compound

Sources & evidence

ORD record
ord-c4b72b62f5244f3db07cfd4d8a5d1613
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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