Water → HCID 23439385, compound

HRID 1210971Notes

Reaction equation

HRID 1210971 reaction equation
[CH3:30][CH2:31][O:32][C:33]([CH3:34])=[O:35].[I:1][c:2]1[c:3]([Cl:19])[c:4]([Cl:18])[c:5]([NH:8][C:9]([C:10]([C:11]([F:12])([F:13])[F:14])([CH3:15])[OH:16])=[O:17])[cH:6][cH:7]1.[O:37]=[CH:38][N:39]([CH3:40])[CH3:41].[OH2:36].[SH:20][c:21]1[cH:22][cH:23][c:24]([C:25](=[O:26])[OH:27])[cH:28][cH:29]1>>[c:2]1([S:20][c:21]2[cH:22][cH:23][c:24]([C:25](=[O:26])[OH:27])[cH:28][cH:29]2)[c:3]([Cl:19])[c:4]([Cl:18])[c:5]([NH:8][C:9]([C:10]([C:11]([F:12])([F:13])[F:14])([CH3:15])[OH:16])=[O:17])[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 957384-Mercaptobenzoic acidHCID 23439414HCID 23439414, compound

Product 1

HCID 23439385HCID 23439385, compound

Sources & evidence

ORD record
ord-1f96ef716b524f629b7feba67ac407c5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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