Ethanol → HCID 18548758, compound

HRID 156002Notes

Reaction equation

HRID 156002 reaction equation
[CH2:31]1[CH2:32][O:33][CH2:34][CH2:35][NH:36]1.[CH3:37][CH2:38][OH:39].[Cl:1][CH2:2][c:3]1[n:4][c:5](-[c:8]2[cH:9][c:10]([C:14]3=[N:15][c:16]4[c:17]([cH:22][c:23](-[n:26]5[cH:27][cH:28][cH:29][cH:30]5)[cH:24][cH:25]4)[NH:18][C:19](=[O:21])[CH2:20]3)[cH:11][cH:12][cH:13]2)[o:6][cH:7]1.[OH2:40]>>[CH2:2]([c:3]1[n:4][c:5](-[c:8]2[cH:9][c:10]([C:14]3=[N:15][c:16]4[c:17]([cH:22][c:23](-[n:26]5[cH:27][cH:28][cH:29][cH:30]5)[cH:24][cH:25]4)[NH:18][C:19](=[O:21])[CH2:20]3)[cH:11][cH:12][cH:13]2)[o:6][cH:7]1)[N:36]1[CH2:31][CH2:32][O:33][CH2:34][CH2:35]1

Participants

5

Reactant 4

HCID 702EthanolHCID 962WaterHCID 8083MorpholineHCID 18548707HCID 18548707, compound

Product 1

HCID 18548758HCID 18548758, compound

Sources & evidence

ORD record
ord-2416b8d840e2446cb0bcc4b959e46018
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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