Ethanol → HCID 69312125, compound

HRID 214340Notes

Reaction equation

HRID 214340 reaction equation
[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:44][CH2:45][O:46][C:47]([CH3:48])=[O:49].[CH3:52][CH2:53][OH:54].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][c:10]2[n:11]([CH3:36])[c:12](-[c:15]3[n:16][c:17]([NH:21][c:22]4[cH:23][cH:24][c:25]([S:28]([NH:29][CH2:30][CH2:31][O:32][CH3:33])(=[O:34])=[O:35])[cH:26][cH:27]4)[n:18][cH:19][cH:20]3)[cH:13][n:14]2)[cH:6][cH:7]1.[H:50][H:51]>>[cH:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][c:10]2[n:11]([CH3:36])[c:12](-[c:15]3[n:16][c:17]([NH:21][c:22]4[cH:23][cH:24][c:25]([S:28]([NH:29][CH2:30][CH2:31][O:32][CH3:33])(=[O:34])=[O:35])[cH:26][cH:27]4)[n:18][cH:19][cH:20]3)[cH:13][n:14]2)[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 702EthanolHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 69311894HCID 69311894, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 69312125HCID 69312125, compound

Sources & evidence

ORD record
ord-102973bae38d4f9bb200794e87cf219b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…