Ethyl Acetate → HCID 178501909, compound

HRID 1539695Notes

Reaction equation

HRID 1539695 reaction equation
[CH2:39]([P:40]([OH:41])([OH:42])=[O:43])[CH2:44][CH3:45].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[NH2:18][c:19]1[cH:20][c:21](-[c:26]2[n:27][o:28][c:29]([CH:31]3[CH2:32][N:33]([C:35](=[O:36])[O:37][CH3:38])[CH2:34]3)[n:30]2)[cH:22][cH:23][c:24]1[CH3:25].[nH:1]1[n:2][c:3](-[c:6]2[cH:7][c:8]3[n:9]([cH:10][cH:11]2)[c:12]([C:15](=[O:16])[OH:17])[cH:13][n:14]3)[cH:4][cH:5]1>>[nH:1]1[n:2][c:3](-[c:6]2[cH:7][c:8]3[n:9]([cH:10][cH:11]2)[c:12]([C:15](=[O:17])[NH:18][c:19]2[cH:20][c:21](-[c:26]4[n:27][o:28][c:29]([CH:31]5[CH2:32][N:33]([C:35](=[O:36])[O:37][CH3:38])[CH2:34]5)[n:30]4)[cH:22][cH:23][c:24]2[CH3:25])[cH:13][n:14]3)[cH:4][cH:5]1

Participants

5

Reactant 4

HCID 8857Ethyl AcetateHCID 204484Propylphosphonic acidHCID 86677444Methyl 3-(3-(3-amino-4-methylphenyl)-1,2,4-oxadiazol-5-yl)azetidine-1-carboxylateHCID 178524703HCID 178524703, compound

Product 1

HCID 178501909HCID 178501909, compound

Sources & evidence

ORD record
ord-84d2bc0e4469468b9e5525fc762bcdd3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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