Methanesulfonic Acid → HCID 66710945, compound

HRID 1571324Notes

Reaction equation

HRID 1571324 reaction equation
[CH3:1][S:2](=[O:3])[c:4]1[n:5][n:6]2[c:7]([cH:8][n:9]1)[cH:10][cH:11][c:12]2-[c:13]1[c:14]([O:19][CH3:20])[cH:15][cH:16][cH:17][cH:18]1.[CH3:21][S:22](=[O:23])(=[O:24])[OH:25].[CH3:55][O:56][CH2:57][CH:58]([OH:59])[CH3:60].[NH2:26][c:27]1[c:28]([O:46][CH3:47])[cH:29][c:30]([CH:33]2[CH2:34][CH2:35][N:36]([CH2:39][CH:40]([C:41]([F:42])([F:43])[F:44])[OH:45])[CH2:37][CH2:38]2)[cH:31][cH:32]1.[OH:48][C:49]([C:50]([F:51])([F:52])[F:53])=[O:54]>>[c:4]1([NH:26][c:27]2[c:28]([O:46][CH3:47])[cH:29][c:30]([CH:33]3[CH2:34][CH2:35][N:36]([CH2:39][CH:40]([C:41]([F:42])([F:43])[F:44])[OH:45])[CH2:37][CH2:38]3)[cH:31][cH:32]2)[n:5][n:6]2[c:7]([cH:8][n:9]1)[cH:10][cH:11][c:12]2-[c:13]1[c:14]([O:19][CH3:20])[cH:15][cH:16][cH:17][cH:18]1

Participants

6

Reactant 5

HCID 6395Methanesulfonic AcidHCID 6422Trifluoroacetic acidHCID 79001-Methoxy-2-propanolHCID 667107912-Methanesulfinyl-7-(2-methoxy-phenyl)-pyrrolo[2,1-f][1,2,4]triazineHCID 66712007HCID 66712007, compound

Product 1

HCID 66710945HCID 66710945, compound

Sources & evidence

ORD record
ord-1c6247bd24d94934a7e1786228f76035
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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