Ethanol → HCID 13768048, compound

HRID 1128442Notes

Reaction equation

HRID 1128442 reaction equation
[C:1](=[O:2])([CH3:3])[NH:4][C:5](=[S:6])[N:7]1[CH:8]([c:12]2[c:13]([O:18][CH2:19][CH2:20][N:21]3[CH2:22][CH2:23][N:24]([c:27]4[cH:28][c:29]([F:33])[cH:30][cH:31][cH:32]4)[CH2:25][CH2:26]3)[cH:14][cH:15][cH:16][cH:17]2)[S:9][CH2:10][CH2:11]1.[CH3:36][CH2:37][OH:38].[Na+:35].[OH-:34]>>[NH2:4][C:5](=[S:6])[N:7]1[CH:8]([c:12]2[c:13]([O:18][CH2:19][CH2:20][N:21]3[CH2:22][CH2:23][N:24]([c:27]4[cH:28][c:29]([F:33])[cH:30][cH:31][cH:32]4)[CH2:25][CH2:26]3)[cH:14][cH:15][cH:16][cH:17]2)[S:9][CH2:10][CH2:11]1

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 13768030HCID 13768030, compound

Product 1

HCID 13768048HCID 13768048, compound

Sources & evidence

ORD record
ord-da523cd0df3147c6a53b31d9cb784ec8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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