Water → HCID 66755192, compound

HRID 145670Notes

Reaction equation

HRID 145670 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([S:9](=[O:10])(=[O:11])[Cl:12])[cH:7][cH:8]1.[CH3:52][CH2:53][N:54]([CH2:55][CH3:56])[CH2:57][CH3:58].[CH3:60][N:61]([c:62]1[cH:63][cH:64][n:65][cH:66][cH:67]1)[CH3:68].[Cl:13][c:14]1[cH:15][cH:16][c:17]2[c:18]([n:19]([CH:23]([C:24](=[O:25])[N:26]3[CH2:27][CH2:28][N:29]([CH:32]4[CH2:33][CH2:34][N:35]([C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[CH2:36][CH2:37]4)[CH2:30][CH2:31]3)[c:45]3[cH:46][cH:47][cH:48][cH:49][cH:50]3)[c:20](=[O:22])[nH:21]2)[cH:51]1.[O:69]1[CH2:70][CH2:71][CH2:72][CH2:73]1.[OH2:59]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([S:9](=[O:10])(=[O:11])[n:21]2[c:17]3[cH:16][cH:15][c:14]([Cl:13])[cH:51][c:18]3[n:19]([CH:23]([C:24](=[O:25])[N:26]3[CH2:27][CH2:28][N:29]([CH:32]4[CH2:33][CH2:34][N:35]([C:38](=[O:39])[O:40][C:41]([CH3:42])([CH3:43])[CH3:44])[CH2:36][CH2:37]4)[CH2:30][CH2:31]3)[c:45]3[cH:46][cH:47][cH:48][cH:49][cH:50]3)[c:20]2=[O:22])[cH:7][cH:8]1

Participants

7

Reactant 6

HCID 962WaterHCID 74014-Methoxybenzenesulfonyl chlorideHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 142844-(Dimethylamino)pyridineHCID 66754935HCID 66754935, compound

Product 1

HCID 66755192HCID 66755192, compound

Sources & evidence

ORD record
ord-8805d7129164472497da7973a3fd9b14
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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