Trifluoroacetic acid → 4-[2-[(6-Chloro-3-pyridinyl)amino]-5-[1-(4-methylsulfonylpiperazin-1-yl)ethyl]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine

HRID 2142985Notes

Reaction equation

HRID 2142985 reaction equation
[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:8][c:9]2[n:10][cH:11][c:12]([CH:41]([CH3:42])[N:43]3[CH2:44][CH2:45][N:46]([S:49](=[O:50])(=[O:51])[CH3:52])[CH2:47][CH2:48]3)[cH:13][c:14]2-[c:15]2[n:16][c:17]([N:22]([CH2:23][c:24]3[cH:25][cH:26][c:27]([O:28][CH3:29])[cH:30][cH:31]3)[CH2:32][c:33]3[cH:34][cH:35][c:36]([O:37][CH3:38])[cH:39][cH:40]3)[n:18][c:19]([CH3:21])[n:20]2)[cH:6][n:7]1.[F:61][C:62]([F:63])([F:64])[C:65]([OH:66])=[O:67].[OH:53][S:54]([C:55]([F:56])([F:57])[F:58])(=[O:59])=[O:60]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:8][c:9]2[n:10][cH:11][c:12]([CH:41]([CH3:42])[N:43]3[CH2:44][CH2:45][N:46]([S:49](=[O:50])(=[O:51])[CH3:52])[CH2:47][CH2:48]3)[cH:13][c:14]2-[c:15]2[n:16][c:17]([NH2:22])[n:18][c:19]([CH3:21])[n:20]2)[cH:6][n:7]1

Participants

4

Reactant 3

HCID 6422Trifluoroacetic acidHCID 62406Trifluoromethanesulfonic acidHCID 87068326HCID 87068326, compound

Product 1

HCID 723233864-[2-[(6-Chloro-3-pyridinyl)amino]-5-[1-(4-methylsulfonylpiperazin-1-yl)ethyl]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine

Sources & evidence

ORD record
ord-1d4515ef338840459a70b677c733f3ce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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