Water → HCID 68649854, compound

HRID 698030Notes

Reaction equation

HRID 698030 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:49]2)[CH:20]=[C:21]([C:30](=[O:31])[NH:32][c:33]2[cH:34][cH:35][c:36]([S:39][CH2:40][c:41]4[n:42]([CH2:46][CH2:47][CH3:48])[cH:43][cH:44][n:45]4)[cH:37][cH:38]2)[CH2:22][CH2:23][CH2:24][N:25]3[CH2:26][CH:27]([CH3:28])[CH3:29])[cH:13][cH:14]1.[CH3:61][S:62][CH3:63].[Cl:50][c:51]1[cH:52][cH:53][cH:54][c:55]([C:56]([O:57][OH:59])=[O:58])[cH:60]1.[Cl:65][CH2:66][Cl:67].[OH2:64]>>[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:49]2)[CH:20]=[C:21]([C:30](=[O:31])[NH:32][c:33]2[cH:34][cH:35][c:36]([S:39]([CH2:40][c:41]4[n:42]([CH2:46][CH2:47][CH3:48])[cH:43][cH:44][n:45]4)=[O:58])[cH:37][cH:38]2)[CH2:22][CH2:23][CH2:24][N:25]3[CH2:26][CH:27]([CH3:28])[CH3:29])[cH:13][cH:14]1

Participants

6

Reactant 5

HCID 962WaterHCID 1068Dimethyl SulfideHCID 6344DichloromethaneHCID 70297m-Chloroperbenzoic acidHCID 68649978HCID 68649978, compound

Product 1

HCID 68649854HCID 68649854, compound

Sources & evidence

ORD record
ord-597a23a98d754029a6835c2c2f50931a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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