Ethanol → HCID 10189117, compound

HRID 701540Notes

Reaction equation

HRID 701540 reaction equation
[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[CH3:51][CH2:52][OH:53].[Cl:26][c:27]1[cH:28][c:29]2[c:30]([n:31]([CH3:41])[c:32](=[O:40])[n:33]2[CH:34]2[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]2)[cH:42][cH:43]1.[O:1]1[CH:2]([CH2:4][n:5]2[n:6][c:7](-[c:16]3[cH:17][cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]3)[c:8](-[c:10]3[cH:11][cH:12][n:13][cH:14][cH:15]3)[cH:9]2)[CH2:3]1>>[OH:1][CH:2]([CH2:3][N:37]1[CH2:36][CH2:35][CH:34]([n:33]2[c:29]3[cH:28][c:27]([Cl:26])[cH:43][cH:42][c:30]3[n:31]([CH3:41])[c:32]2=[O:40])[CH2:39][CH2:38]1)[CH2:4][n:5]1[n:6][c:7](-[c:16]2[cH:17][cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]2)[c:8](-[c:10]2[cH:11][cH:12][n:13][cH:14][cH:15]2)[cH:9]1

Participants

5

Reactant 4

HCID 702EthanolHCID 8471TriethylamineHCID 22293694HCID 22293694, compoundHCID 22293792HCID 22293792, compound

Product 1

HCID 10189117HCID 10189117, compound

Sources & evidence

ORD record
ord-943610fab3b54032b9d43af7be795aa5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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