Water → HCID 14441128, compound

HRID 1549653Notes

Reaction equation

HRID 1549653 reaction equation
[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([OH:25])[CH2:9][CH2:10][N:11]([CH2:14][CH2:15][NH:16][C:17](=[O:18])[N:19]3[C:20](=[O:24])[CH2:21][CH2:22][CH2:23]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1.[OH2:26].[c:27]1([CH3:28])[cH:29][cH:30][c:31]([S:32]([OH:33])(=[O:34])=[O:35])[cH:36][cH:37]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([C:8]2=[CH:9][CH2:10][N:11]([CH2:14][CH2:15][NH:16][C:17](=[O:18])[N:19]3[C:20](=[O:24])[CH2:21][CH2:22][CH2:23]3)[CH2:12][CH2:13]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 962WaterHCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 14441123HCID 14441123, compound

Product 1

HCID 14441128HCID 14441128, compound

Sources & evidence

ORD record
ord-c002b51c21cf45959e5d63b69613ecee
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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