Tetrahydrofuran → 1-[4-(6-Chloro-pyrimidin-4-ylmethyl)-phenyl]-3-(4-ethyl-phenyl)-urea

HRID 290113

Reaction equation

HRID 290113 reaction equation
[CH2:25]([CH3:26])[c:27]1[cH:28][cH:29][c:30]([N:33]=[C:34]=[O:35])[cH:31][cH:32]1.[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH:1]([N:2]([CH2:3][CH3:4])[CH:5]([CH3:6])[CH3:7])([CH3:8])[CH3:9].[Cl:10][c:11]1[cH:12][c:13]([CH2:17][c:18]2[cH:19][cH:20][c:21]([NH2:24])[cH:22][cH:23]2)[n:14][cH:15][n:16]1>>[Cl:10][c:11]1[cH:12][c:13]([CH2:17][c:18]2[cH:19][cH:20][c:21]([NH:24][C:34]([NH:33][c:30]3[cH:29][cH:28][c:27]([CH2:25][CH3:26])[cH:32][cH:31]3)=[O:35])[cH:22][cH:23]2)[n:14][cH:15][n:16]1

Participants

5

Reactant 4

HCID 8028TetrahydrofuranHCID 81531DiisopropylethylamineHCID 900074-Ethylphenyl isocyanateHCID 858915834-(6-Chloro-pyrimidin-4-ylmethyl)-phenylamine

Product 1

HCID 586593551-[4-(6-Chloro-pyrimidin-4-ylmethyl)-phenyl]-3-(4-ethyl-phenyl)-urea

Sources & evidence

ORD record
ord-b7ad112c90e648cc946a1960455d4f7f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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