Trifluoroacetic acid → HCID 66611700, compound

HRID 2329282Notes

Reaction equation

[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][c:6]([NH:12][c:13]2[n:14][cH:15][c:16]([CH:45]([CH3:46])[N:47]3[CH2:48][CH2:49][N:50]([S:53](=[O:54])(=[O:55])[CH3:56])[CH2:51][CH2:52]3)[cH:17][c:18]2-[c:19]2[n:20][c:21]([N:26]([CH2:27][c:28]3[cH:29][cH:30][c:31]([O:32][CH3:33])[cH:34][cH:35]3)[CH2:36][c:37]3[cH:38][cH:39][c:40]([O:41][CH3:42])[cH:43][cH:44]3)[n:22][c:23]([CH3:25])[n:24]2)[cH:7][n:8][c:9]1[O:10][CH3:11].[F:65][C:66]([F:67])([F:68])[C:69]([OH:70])=[O:71].[OH:57][S:58]([C:59]([F:60])([F:61])[F:62])(=[O:63])=[O:64]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][c:6]([NH:12][c:13]2[n:14][cH:15][c:16]([CH:45]([CH3:46])[N:47]3[CH2:48][CH2:49][N:50]([S:53](=[O:54])(=[O:55])[CH3:56])[CH2:51][CH2:52]3)[cH:17][c:18]2-[c:19]2[n:20][c:21]([NH2:26])[n:22][c:23]([CH3:25])[n:24]2)[cH:7][n:8][c:9]1[O:10][CH3:11]

Participants

Reactant 3

HCID 6422Trifluoroacetic acid

HCID 62406Trifluoromethanesulfonic acid

HCID 66612094N,N-bis[(4-methoxyphenyl)methyl]-4-[2-[(6-methoxy-5-propan-2-yl-3-pyridinyl)amino]-5-[1-(4-methylsulfonylpiperazin-1-yl)ethyl]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine

Product 1

HCID 66611700HCID 66611700, compound

Sources & evidence

ORD record: ord-c5906819dfbf4c0bb788b3f2cabec799
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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