1,4-Dioxane → Methyl 4-[(4-thiophen-3-yl-pyrimidin-2-ylamino)-methyl]-benzoate

HRID 139808

Reaction equation

HRID 139808 reaction equation
[CH2:34]1[O:35][CH2:36][CH2:37][O:38][CH2:39]1.[CH:25]([N:26]([CH2:27][CH3:28])[CH:29]([CH3:30])[CH3:31])([CH3:32])[CH3:33].[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[cH:9][s:10][cH:11][cH:12]2)[n:7]1.[NH2:13][CH2:14][c:15]1[cH:16][cH:17][c:18]([C:19](=[O:20])[O:21][CH3:22])[cH:23][cH:24]1>>[c:2]1([NH:13][CH2:14][c:15]2[cH:16][cH:17][c:18]([C:19](=[O:20])[O:21][CH3:22])[cH:23][cH:24]2)[n:3][cH:4][cH:5][c:6](-[c:8]2[cH:9][s:10][cH:11][cH:12]2)[n:7]1

Participants

5

Reactant 4

HCID 312751,4-DioxaneHCID 81531DiisopropylethylamineHCID 571728Methyl 4-(aminomethyl)benzoateHCID 141179422-Chloro-4-(thiophen-3-yl)pyrimidine

Product 1

HCID 58930569Methyl 4-[(4-thiophen-3-yl-pyrimidin-2-ylamino)-methyl]-benzoate

Sources & evidence

ORD record
ord-77a466fec03f4d7d993c28d5500714f8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

Loading…