Water → HCID 59204953, compound

HRID 678450Notes

Reaction equation

HRID 678450 reaction equation
[CH3:12][CH2:13][N:14]([CH2:15][CH3:16])[CH2:17][CH3:18].[CH3:39][N:40]([CH3:41])[c:42]1[cH:43][cH:44][n:45][cH:46][cH:47]1.[Cl:48][CH2:49][Cl:50].[F:19][c:20]1[c:21]([N:29]2[CH2:30][CH2:31][CH:32]([CH2:35][CH2:36][OH:37])[CH2:33][CH2:34]2)[cH:22][cH:23][c:24]([N+:26](=[O:27])[O-:28])[cH:25]1.[OH2:38].[c:1]1([CH3:11])[cH:2][cH:3][c:4]([S:7](=[O:8])(=[O:9])[Cl:10])[cH:5][cH:6]1>>[c:1]1([CH3:11])[cH:2][cH:3][c:4]([S:7](=[O:8])(=[O:9])[O:37][CH2:36][CH2:35][CH:32]2[CH2:31][CH2:30][N:29]([c:21]3[c:20]([F:19])[cH:25][c:24]([N+:26](=[O:27])[O-:28])[cH:23][cH:22]3)[CH2:34][CH2:33]2)[cH:5][cH:6]1

Participants

7

Reactant 6

HCID 962WaterHCID 6344DichloromethaneHCID 73974-Toluenesulfonyl chlorideHCID 8471TriethylamineHCID 142844-(Dimethylamino)pyridineHCID 59204893HCID 59204893, compound

Product 1

HCID 59204953HCID 59204953, compound

Sources & evidence

ORD record
ord-a98a989e7965431faba36b039a65251b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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