Tetrahydrofuran → [3-({[2-(3-Fluoro-phenyl)-4-methyl-pyrimidine-5-carbonyl]-amino}-methyl)-benzyl]-carbamic acid tert-butyl ester

HRID 688924Notes

Reaction equation

HRID 688924 reaction equation
[C:18]([c:19]1[nH:20][cH:21][cH:22][n:23]1)([c:24]1[nH:25][cH:26][cH:27][n:28]1)=[O:29].[C:30]([CH3:31])([CH3:32])([CH3:33])[O:34][C:35]([NH:36][CH2:37][c:38]1[cH:39][c:40]([CH2:44][NH2:45])[cH:41][cH:42][cH:43]1)=[O:46].[CH2:47]1[O:48][CH2:49][CH2:50][CH2:51]1.[CH3:52][CH2:53][O:54][C:55]([CH3:56])=[O:57].[F:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][cH:10][c:11]([C:15](=[O:16])[OH:17])[c:12]([CH3:14])[n:13]2)[cH:5][cH:6][cH:7]1>>[F:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][cH:10][c:11]([C:15](=[O:17])[NH:45][CH2:44][c:40]3[cH:39][c:38]([CH2:37][NH:36][C:35]([O:34][C:30]([CH3:31])([CH3:32])[CH3:33])=[O:46])[cH:43][cH:42][cH:41]3)[c:12]([CH3:14])[n:13]2)[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 2756043tert-butyl N-((3-(aminomethyl)phenyl)methyl)carbamateHCID 5250894Bis-(1H-imidazol-2-YL)-methanoneHCID 617025872-(3-Fluorophenyl)-4-methylpyrimidine-5-carboxylic acid

Product 1

HCID 69123142[3-({[2-(3-Fluoro-phenyl)-4-methyl-pyrimidine-5-carbonyl]-amino}-methyl)-benzyl]-carbamic acid tert-butyl ester

Sources & evidence

ORD record
ord-5d95835c154144f3a09d11d2b52933a2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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