Toluene → racemic-Tasocitinib

HRID 214859Notes

Reaction equation

HRID 214859 reaction equation
[C:1](#[N:2])[CH2:3][C:4]([O:6][CH2:5][CH3:7])=[O:8].[CH3:16][N:17]([c:18]1[c:19]2[c:20]([n:21][cH:22][n:23]1)[nH:24][cH:25][cH:26]2)[CH:27]1[CH2:28][NH:29][CH2:30][CH2:31][CH:32]1[CH3:33].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[CH3:9][CH2:10][N:11]([CH2:12][CH3:13])[CH2:14][CH3:15]>>[C:1](#[N:2])[CH2:3][C:4](=[O:6])[N:29]1[CH2:28][CH:27]([N:17]([CH3:16])[c:18]2[c:19]3[c:20]([n:21][cH:22][n:23]2)[nH:24][cH:25][cH:26]3)[CH:32]([CH3:33])[CH2:31][CH2:30]1

Participants

5

Reactant 4

HCID 1140TolueneHCID 7764Ethyl cyanoacetateHCID 8471TriethylamineHCID 12084830N-Methyl-N-[(3S,4S)-4-methyl-3-piperidyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Product 1

HCID 9818231racemic-Tasocitinib

Sources & evidence

ORD record
ord-0153c40e9ce14b4b90ad5566999853a2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…