Ethanol → 4-(5-Amino-6-methylisoquinolin-1-ylamino)benzonitrile

HRID 956030Notes

Reaction equation

HRID 956030 reaction equation
[C:29](=[O:30])([O-:31])[O-:32].[CH3:1][c:2]1[c:3]([N+:21]([O-:22])=[O:23])[c:4]2[cH:5][cH:6][n:7][c:8]([NH:12][c:13]3[cH:14][cH:15][c:16]([C:17]#[N:18])[cH:19][cH:20]3)[c:9]2[cH:10][cH:11]1.[CH3:35][CH2:36][OH:37].[Na+:33].[Na+:34].[OH2:24].[OH2:25].[Sn:26]([Cl:27])[Cl:28]>>[CH3:1][c:2]1[c:3]([NH2:21])[c:4]2[cH:5][cH:6][n:7][c:8]([NH:12][c:13]3[cH:14][cH:15][c:16]([C:17]#[N:18])[cH:19][cH:20]3)[c:9]2[cH:10][cH:11]1

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ion2×HCID 962Water2×HCID 19660Carbonate IonHCID 24479Stannous ChlorideHCID 687253564-(6-Methyl-5-nitroisoquinolin-1-ylamino)benzonitrile

Product 1

HCID 687254604-(5-Amino-6-methylisoquinolin-1-ylamino)benzonitrile

Sources & evidence

ORD record
ord-e7c71ed3a1cf4561b2106330bae75156
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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