Sodium ion → HCID 178450545, compound

HRID 688675Notes

Reaction equation

HRID 688675 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:46]2)[CH:20]=[C:21]([C:29](=[O:30])[NH:31][c:32]2[cH:33][cH:34][c:35]([CH:38]([c:39]4[n:40][cH:41][cH:42][cH:43][cH:44]4)[OH:45])[cH:36][cH:37]2)[CH2:22][CH2:23][N:24]3[S:25](=[O:26])(=[O:27])[CH3:28])[cH:13][cH:14]1.[Cl:65][CH2:66][Cl:67].[Na+:63].[Na+:64].[OH:47][O:48][C:49]([c:50]1[cH:51][c:52]([Cl:53])[cH:54][cH:55][cH:56]1)=[O:57].[S:58]([O-:59])([O-:60])(=[O:61])=[S:62]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][CH2:6][CH2:7][O:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[cH:16][cH:17][c:18]3[c:19]([cH:46]2)[CH:20]=[C:21]([C:29](=[O:30])[NH:31][c:32]2[cH:33][cH:34][c:35]([CH:38]([c:39]4[n+:40]([O-:47])[cH:41][cH:42][cH:43][cH:44]4)[OH:45])[cH:36][cH:37]2)[CH2:22][CH2:23][N:24]3[S:25](=[O:26])(=[O:27])[CH3:28])[cH:13][cH:14]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 1084Thiosulfate ionHCID 6344DichloromethaneHCID 70297m-Chloroperbenzoic acidHCID 69521978HCID 69521978, compound

Product 1

HCID 178450545HCID 178450545, compound

Sources & evidence

ORD record
ord-98209ed0f3794cd99ddd6e8fe9a663d4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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