Sodium ion → HCID 57693596, compound

HRID 282737Notes

Reaction equation

HRID 282737 reaction equation
[CH2:12]([c:13]1[cH:14][cH:15][cH:16][cH:17][cH:18]1)[n:19]1[cH:20][cH:21][c:22]2[c:23]1[n:24][c:25]([F:39])[n:26][c:27]2[O:28][c:29]1[c:30]([CH3:38])[cH:31][c:32]([C:33]#[N:34])[cH:35][c:36]1[CH3:37].[H-:11].[NH2:1][c:2]1[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1.[Na+:10].[OH2:40]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9]1)[c:25]1[n:24][c:23]2[n:19]([CH2:12][c:13]3[cH:14][cH:15][cH:16][cH:17][cH:18]3)[cH:20][cH:21][c:22]2[c:27]([O:28][c:29]2[c:30]([CH3:38])[cH:31][c:32]([C:33]#[N:34])[cH:35][c:36]2[CH3:37])[n:26]1

Participants

6

Reactant 5

HCID 923Sodium ionHCID 962WaterHCID 133964-AminobenzonitrileHCID 166653HydrideHCID 576935774-(7-benzyl-2-fluoro-7H-pyrrolo[2,3-d]pyrimidin-4-yloxy)-3,5-dimethyl-benzonitrile

Product 1

HCID 57693596HCID 57693596, compound

Sources & evidence

ORD record
ord-9807b9964b464bde8bdfe5e75400c788
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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