1-Methoxy-2-propanol → N-{2-[2-(4-Fluoro-3-morpholin-4-yl-phenylamino)-pyrrolo[2,1-f][1,2,4]triazin-7-yl]-phenyl}-N-methyl-methanesulfonamide

HRID 679283

Reaction equation

HRID 679283 reaction equation
[CH3:15][S:16](=[O:17])[c:18]1[n:19][n:20]2[c:21]([cH:22][n:23]1)[cH:24][cH:25][c:26]2-[c:27]1[c:28]([N:33]([S:34](=[O:35])(=[O:36])[CH3:37])[CH3:38])[cH:29][cH:30][cH:31][cH:32]1.[CH3:48][O:49][CH2:50][CH:51]([OH:52])[CH3:53].[CH:39]([N:40]([CH2:41][CH3:42])[CH:43]([CH3:44])[CH3:45])([CH3:46])[CH3:47].[F:1][c:2]1[c:3]([N:9]2[CH2:10][CH2:11][O:12][CH2:13][CH2:14]2)[cH:4][c:5]([NH2:8])[cH:6][cH:7]1>>[F:1][c:2]1[c:3]([N:9]2[CH2:10][CH2:11][O:12][CH2:13][CH2:14]2)[cH:4][c:5]([NH:8][c:18]2[n:19][n:20]3[c:21]([cH:22][n:23]2)[cH:24][cH:25][c:26]3-[c:27]2[c:28]([N:33]([S:34](=[O:35])(=[O:36])[CH3:37])[CH3:38])[cH:29][cH:30][cH:31][cH:32]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 79001-Methoxy-2-propanolHCID 81531DiisopropylethylamineHCID 392396264-Fluoro-3-(morpholin-4-yl)anilineHCID 54577677N-[2-(2-M ethanesulfinyl-pyrrolo[2,1-f][1,2,4]triazin-7-yl)-phenyl]-N-methyl-methanesulfonamide

Product 1

HCID 66711832N-{2-[2-(4-Fluoro-3-morpholin-4-yl-phenylamino)-pyrrolo[2,1-f][1,2,4]triazin-7-yl]-phenyl}-N-methyl-methanesulfonamide

Sources & evidence

ORD record
ord-a515898fc17844c485a35df1d6cb5016
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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