1-Methoxy-2-propanol → [7-(3-Methanesulfonyl-phenyl)-pyrrolo[2,1-f][1,2,4]triazin-2-yl]-[6-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amine

HRID 2320937Notes

Reaction equation

HRID 2320937 reaction equation
[CH3:16][S:17](=[O:18])[c:19]1[n:20][n:21]2[c:22]([cH:23][n:24]1)[cH:25][cH:26][c:27]2-[c:28]1[cH:29][c:30]([S:34](=[O:35])(=[O:36])[CH3:37])[cH:31][cH:32][cH:33]1.[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([CH2:8][c:9]2[cH:10][cH:11][cH:12][c:13]([NH2:15])[n:14]2)[CH2:6][CH2:7]1.[CH3:47][O:48][CH2:49][CH:50]([OH:51])[CH3:52].[CH:38]([N:39]([CH2:40][CH3:41])[CH:42]([CH3:43])[CH3:44])([CH3:45])[CH3:46]>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([CH2:8][c:9]2[cH:10][cH:11][cH:12][c:13]([NH:15][c:19]3[n:20][n:21]4[c:22]([cH:23][n:24]3)[cH:25][cH:26][c:27]4-[c:28]3[cH:29][c:30]([S:34](=[O:35])(=[O:36])[CH3:37])[cH:31][cH:32][cH:33]3)[n:14]2)[CH2:6][CH2:7]1

Participants

5

Reactant 4

HCID 79001-Methoxy-2-propanolHCID 81531DiisopropylethylamineHCID 120778076-[(4-Methylpiperazin-1-yl)methyl]pyridin-2-amineHCID 667114002-Methanesulfinyl-7-(3-methanesulfonyl-phenyl)-pyrrolo[2,1-f][1,2,4]triazine

Product 1

HCID 66712320[7-(3-Methanesulfonyl-phenyl)-pyrrolo[2,1-f][1,2,4]triazin-2-yl]-[6-(4-methyl-piperazin-1-ylmethyl)-pyridin-2-yl]-amine

Sources & evidence

ORD record
ord-4244ce588c8d42979cc5f7fcc004e500
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…