Water → HCID 46861604, compound

HRID 202042Notes

Reaction equation

HRID 202042 reaction equation
[Br:1][c:2]1[c:3](-[n:9]2[n:10][c:11]3[c:20]4[c:15]([n:14]([CH2:21][c:22]5[cH:23][cH:24][c:25](-[n:28]6[n:29][cH:30][cH:31][cH:32]6)[cH:26][cH:27]5)[n:13][c:12]-3[c:33]2=[O:34])[cH:16][cH:17][cH:18][cH:19]4)[c:4]([F:8])[cH:5][cH:6][cH:7]1.[C-:41]#[N:42].[C-:44]#[N:45].[CH3:36][N:37]([CH3:38])[CH:39]=[O:40].[OH2:35].[Zn+2:43]>>[c:2]1([C:36]#[N:37])[c:3](-[n:9]2[n:10][c:11]3[c:20]4[c:15]([n:14]([CH2:21][c:22]5[cH:23][cH:24][c:25](-[n:28]6[n:29][cH:30][cH:31][cH:32]6)[cH:26][cH:27]5)[n:13][c:12]-3[c:33]2=[O:34])[cH:16][cH:17][cH:18][cH:19]4)[c:4]([F:8])[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 962WaterHCID 5975Cyanide2×HCID 6228DimethylformamideHCID 32051Zinc(2+)HCID 46896509HCID 46896509, compound

Product 1

HCID 46861604HCID 46861604, compound

Sources & evidence

ORD record
ord-3a4737a457ee45f091b6591393176d2c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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