Sodium ion → HCID 69104038, compound

HRID 666869Notes

Reaction equation

HRID 666869 reaction equation
[CH3:32][CH2:33][O:34][C:35]([CH3:36])=[O:37].[CH3:38][N:39]1[CH2:40][CH2:41][CH2:42][C:43]1=[O:44].[H-:7].[NH2:8][c:9]1[n:10][c:11](-[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[c:12](-[c:16]2[cH:17][cH:18][c:19](=[O:25])[n:20]([CH:22]([CH3:23])[CH3:24])[cH:21]2)[n:13][c:14]1[Br:15].[Na+:6].[OH2:45].[nH:1]1[n:2][cH:3][cH:4][cH:5]1>>[n:1]1(-[c:14]2[c:9]([NH2:8])[n:10][c:11](-[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:12](-[c:16]3[cH:17][cH:18][c:19](=[O:25])[n:20]([CH:22]([CH3:23])[CH3:24])[cH:21]3)[n:13]2)[n:2][cH:3][cH:4][cH:5]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 962WaterHCID 1048PyrazoleHCID 8857Ethyl AcetateHCID 13387N-methyl-2-pyrrolidoneHCID 166653HydrideHCID 11429076HCID 11429076, compound

Product 1

HCID 69104038HCID 69104038, compound

Sources & evidence

ORD record
ord-67521ae8b1784d1db4a980c0c5e22a97
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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