Ammonium → HCID 44612144, compound

HRID 2159157Notes

Reaction equation

HRID 2159157 reaction equation
[C:30](=[O:31])([O-:32])[O-:33].[CH3:42][C:43]#[N:44].[Cl-:40].[Cl:1][c:2]1[c:3]([NH:23][c:24]2[n:25][nH:26][c:27]([CH3:29])[cH:28]2)[n:4][c:5]([NH:8][c:9]2[c:10]([F:22])[cH:11][c:12]([CH:16]3[CH2:17][CH2:18][NH:19][CH2:20][CH2:21]3)[c:13]([CH3:15])[cH:14]2)[n:6][cH:7]1.[Cl:36][CH2:37][C:38]#[N:39].[Cs+:34].[Cs+:35].[NH4+:41]>>[Cl:1][c:2]1[c:3]([NH:23][c:24]2[n:25][nH:26][c:27]([CH3:29])[cH:28]2)[n:4][c:5]([NH:8][c:9]2[c:10]([F:22])[cH:11][c:12]([CH:16]3[CH2:17][CH2:18][N:19]([CH2:37][C:38]#[N:39])[CH2:20][CH2:21]3)[c:13]([CH3:15])[cH:14]2)[n:6][cH:7]1

Participants

8

Reactant 7

HCID 223AmmoniumHCID 312ChlorideHCID 6342AcetonitrileHCID 7856ChloroacetonitrileHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 446126165-chloro-N2-(2-fluoro-5-methyl-4-(piperidin-4-yl)phenyl)-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine

Product 1

HCID 44612144HCID 44612144, compound

Sources & evidence

ORD record
ord-b9c67c31790e4716a2bcb068c8299154
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

Loading…