1-Butanol → N4-(1H-indazol-6-yl)-N2-(4-(methylthio)phenyl)-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine

HRID 86836

Reaction equation

HRID 86836 reaction equation
[CH2:46]([OH:47])[CH2:48][CH2:49][CH3:50].[CH3:31][S:32][c:33]1[cH:34][cH:35][c:36]([NH2:37])[cH:38][cH:39]1.[CH3:40][Si:41]([Cl:42])([CH3:43])[CH3:44].[CH3:51][CH2:52][O:53][C:54](=[O:55])[CH3:56].[Cl:1][c:2]1[n:3][c:4]([NH:21][c:22]2[cH:23][cH:24][c:25]3[cH:26][n:27][nH:28][c:29]3[cH:30]2)[c:5]2[c:6]([n:7]1)[n:8]([S:11](=[O:12])(=[O:13])[c:14]1[cH:15][cH:16][c:17]([CH3:18])[cH:19][cH:20]1)[cH:9][cH:10]2.[OH2:45]>>[c:2]1([NH:37][c:36]2[cH:35][cH:34][c:33]([S:32][CH3:31])[cH:39][cH:38]2)[n:3][c:4]([NH:21][c:22]2[cH:23][cH:24][c:25]3[cH:26][n:27][nH:28][c:29]3[cH:30]2)[c:5]2[c:6]([n:7]1)[n:8]([S:11](=[O:12])(=[O:13])[c:14]1[cH:15][cH:16][c:17]([CH3:18])[cH:19][cH:20]1)[cH:9][cH:10]2

Participants

7

Reactant 6

HCID 2631-ButanolHCID 962WaterHCID 6397ChlorotrimethylsilaneHCID 8857Ethyl AcetateHCID 660384-(Methylthio)anilineHCID 866280352-chloro-N-(1H-indazol-6-yl)-7-tosyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Product 1

HCID 57585782N4-(1H-indazol-6-yl)-N2-(4-(methylthio)phenyl)-7-tosyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine

Sources & evidence

ORD record
ord-6a376c0dfa7b4010a7b36c7c320b7e08
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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