Potassium Cation → N'-(2-cyano-5-{3-[(RS)-N-(ethoxycarbonyl)-S-methylsulphonimidoyl]benzylamino}phenyl)-N,N-dimethylformimidamide

HRID 1550860Notes

Reaction equation

HRID 1550860 reaction equation
[Br:15][CH2:16][c:17]1[cH:18][c:19]([S:23](=[O:24])(=[N:25][C:26](=[O:27])[O:28][CH2:29][CH3:30])[CH3:31])[cH:20][cH:21][cH:22]1.[C:32](=[O:33])([O-:34])[O-:35].[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[K+:36].[K+:37].[NH2:1][c:2]1[cH:3][cH:4][c:5]([C:13]#[N:14])[c:6]([N:8]=[CH:9][N:10]([CH3:11])[CH3:12])[cH:7]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([C:13]#[N:14])[c:6]([N:8]=[CH:9][N:10]([CH3:11])[CH3:12])[cH:7]1)[CH2:16][c:17]1[cH:18][c:19]([S:23](=[O:24])(=[N:25][C:26](=[O:27])[O:28][CH2:29][CH3:30])[CH3:31])[cH:20][cH:21][cH:22]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 57787953N'-(5-Amino-2-cyanophenyl)-N,N-dimethylformimidamideHCID 57788029(RS)-S-[3-(bromomethyl)phenyl]-N-(ethoxycarbonyl)-S-methylsulphoximide

Product 1

HCID 57788040N'-(2-cyano-5-{3-[(RS)-N-(ethoxycarbonyl)-S-methylsulphonimidoyl]benzylamino}phenyl)-N,N-dimethylformimidamide

Sources & evidence

ORD record
ord-b332c8e1e4084788aa197734a7477a09
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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