Ethanol → HCID 178522988, compound

HRID 165069Notes

Reaction equation

HRID 165069 reaction equation
[CH3:43][CH2:44][OH:45].[CH:34]([N:35]([CH:36]([CH3:37])[CH3:38])[CH2:39][CH3:40])([CH3:41])[CH3:42].[O:1]=[c:2]1[nH:3][c:4]([C:12]([O:14][CH2:13][CH3:15])=[O:16])[n:5][c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12.[nH:17]1[n:18][c:19]([S:22][CH2:23][CH2:24][O:25][c:26]2[cH:27][c:28]([CH2:32][NH2:33])[cH:29][cH:30][cH:31]2)[n:20][cH:21]1>>[O:1]=[c:2]1[nH:3][c:4]([C:12](=[O:14])[NH:33][CH2:32][c:28]2[cH:27][c:26]([O:25][CH2:24][CH2:23][S:22][c:19]3[n:18][nH:17][cH:21][n:20]3)[cH:31][cH:30][cH:29]2)[n:5][c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12

Participants

5

Reactant 4

HCID 702EthanolHCID 81531DiisopropylethylamineHCID 135437466Ethyl 4-oxo-3,4-dihydroquinazoline-2-carboxylateHCID 178509870HCID 178509870, compound

Product 1

HCID 178522988HCID 178522988, compound

Sources & evidence

ORD record
ord-d498643a6691495eabd6831243758881
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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