Ethanol → HCID 178484229, compound

HRID 98660Notes

Reaction equation

HRID 98660 reaction equation
[CH3:1][N:2]([C:3](=[O:4])[O:5][c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)[CH2:12][CH2:13][N:14]1[c:15]2[c:16]([cH:20][c:21]([NH:24][C:25](=[NH:26])[c:27]3[s:28][cH:29][cH:30][cH:31]3)[cH:22][cH:23]2)[S:17][CH2:18][CH2:19]1.[CH3:32][CH2:33][OH:34].[Na+:37].[OH-:36].[OH2:35]>>[CH3:1][NH:2][CH2:12][CH2:13][N:14]1[c:15]2[c:16]([cH:20][c:21]([NH:24][C:25](=[NH:26])[c:27]3[s:28][cH:29][cH:30][cH:31]3)[cH:22][cH:23]2)[S:17][CH2:18][CH2:19]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 178484232Phenyl methyl(2-(7-(thiophene-2-carboximidamido)-2H-benzo[b][1,4]thiazin-4(3H)-yl)ethyl)carbamate

Product 1

HCID 178484229HCID 178484229, compound

Sources & evidence

ORD record
ord-200c158e099741f2b65415b46ae70eb7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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