Hydrochloric Acid → 2-(5-Amino-1,2,4-thiadiazol-3-yl)-2-(1-carboxy-1-methylethoxyimino)acetic methanesulfonic anhydride

HRID 675023Notes

Reaction equation

HRID 675023 reaction equation
[C:24](=[O:25])([OH:26])[O-:27].[CH3:19][S:20]([Cl:21])(=[O:22])=[O:23].[CH3:30][N:31]([CH3:32])[C:33](=[O:34])[CH3:35].[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[ClH:29].[K+:28].[NH2:1][c:2]1[n:3][c:4]([C:7]([C:8](=[O:9])[OH:10])=[N:11][O:12][C:13]([CH3:14])([CH3:15])[C:16](=[O:17])[OH:18])[n:5][s:6]1.[OH2:42]>>[NH2:1][c:2]1[n:3][c:4]([C:7]([C:8](=[O:9])[O:10][S:20]([CH3:19])(=[O:22])=[O:23])=[N:11][O:12][C:13]([CH3:14])([CH3:15])[C:16](=[O:17])[OH:18])[n:5][s:6]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 813Potassium CationHCID 962WaterHCID 8857Ethyl AcetateHCID 31297Methanesulfonyl chlorideHCID 31374DimethylacetamideHCID 540254892-[[(5-Amino-1,2,4-thiadiazol-3-yl)-carboxymethylidene]amino]oxy-2-methylpropanoic acid

Product 1

HCID 537830312-(5-Amino-1,2,4-thiadiazol-3-yl)-2-(1-carboxy-1-methylethoxyimino)acetic methanesulfonic anhydride

Sources & evidence

ORD record
ord-466fff9bae5341edba47397a4e28d83d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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