Hydrochloric Acid → C-[2-Benzylsulfanyl-6-(4-trifluoromethyl-phenyl)-pyrimidin-4-yl]-methylamine

HRID 2334452Notes

Reaction equation

HRID 2334452 reaction equation
[C:1]([O:2][C:3](=[O:4])[NH:7][CH2:8][c:9]1[n:10][c:11]([S:25][CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[n:12][c:13](-[c:15]2[cH:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]2)[cH:14]1)([CH3:5])([CH3:6])[CH3:33].[ClH:34].[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1>>[NH2:7][CH2:8][c:9]1[n:10][c:11]([S:25][CH2:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[n:12][c:13](-[c:15]2[cH:16][cH:17][c:18]([C:21]([F:22])([F:23])[F:24])[cH:19][cH:20]2)[cH:14]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 66832575[2-Benzylsulfanyl-6-(4-trifluoromethyl-phenyl)-pyrimidin-4-ylmethyl]-carbamic acid tert-butyl ester

Product 1

HCID 66832492C-[2-Benzylsulfanyl-6-(4-trifluoromethyl-phenyl)-pyrimidin-4-yl]-methylamine

Sources & evidence

ORD record
ord-4ae2be4d364a47edbd793e6afa943ba1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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