Water → p-Nitrobenzyl alpha-[3-phenoxymethyl-7-oxo-4-thia-2,6-diazabicyclo[3,2,0]hept-2-en-6-yl]-alpha-(1-toluene-p-sulfonyloxyethylidene)acetate

HRID 2339698

Reaction equation

HRID 2339698 reaction equation
[CH3:45][CH2:46][N:47]([CH2:48][CH3:49])[CH2:50][CH3:51].[CH3:53][N:54]([CH3:55])[CH:56]=[O:57].[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:8][C:9]1=[N:10][CH:11]2[C:12](=[O:33])[N:13]([C:16]([C:17](=[O:18])[O:19][CH2:20][c:21]3[cH:22][cH:23][c:24]([N+:27](=[O:28])[O-:29])[cH:25][cH:26]3)=[C:30]([CH3:31])[OH:32])[CH:14]2[S:15]1.[OH2:52].[c:34]1([CH3:44])[cH:35][cH:36][c:37]([S:40](=[O:41])(=[O:42])[Cl:43])[cH:38][cH:39]1>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[CH2:8][C:9]1=[N:10][CH:11]2[C:12](=[O:33])[N:13]([C:16]([C:17](=[O:18])[O:19][CH2:20][c:21]3[cH:22][cH:23][c:24]([N+:27](=[O:28])[O-:29])[cH:25][cH:26]3)=[C:30]([CH3:31])[O:32][S:40]([c:37]3[cH:36][cH:35][c:34]([CH3:44])[cH:39][cH:38]3)(=[O:41])=[O:42])[CH:14]2[S:15]1

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 73974-Toluenesulfonyl chlorideHCID 8471TriethylamineHCID 70504145p-Nitrobenzyl alpha-[3-phenoxymethyl-7-oxo4-thia-2,6-diazabicyclo[3,2,0]hept-2-en-6-yl]-alpha-(1-hydroxyethylidene)acetate

Product 1

HCID 86735546p-Nitrobenzyl alpha-[3-phenoxymethyl-7-oxo-4-thia-2,6-diazabicyclo[3,2,0]hept-2-en-6-yl]-alpha-(1-toluene-p-sulfonyloxyethylidene)acetate

Sources & evidence

ORD record
ord-8dbf5e5dbe2a4f7092eccb800c47ded1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Linked notes

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