Ammonium → Methyl 3-[4-(1,4-dimethyl-2-oxo-3-pyridinyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

HRID 2318626Notes

Reaction equation

HRID 2318626 reaction equation
[Br:1][CH2:2][CH2:3][Br:4].[CH2:5]=[CH2:6].[CH2:71]1[O:72][CH2:73][CH2:74][CH2:75]1.[CH3:12][n:13]1[c:14](=[O:21])[c:15]([I:20])[c:16]([CH3:19])[cH:17][cH:18]1.[CH3:22][n:23]1[cH:24][c:25]([I:26])[c:27]([CH3:28])[cH:29][c:30]1=[O:31].[CH3:48][O:49][C:50]([CH:51]([NH:52][C:53](=[O:54])[O:55][C:56]([CH3:57])([CH3:58])[CH3:59])[CH2:60][c:61]1[cH:62][cH:63][c:64]([I:67])[cH:65][cH:66]1)=[O:68].[CH3:7][Si:8]([CH3:9])([CH3:10])[Cl:11].[Cl-:69].[NH4+:70].[Zn:76].[o:32]1[cH:33][cH:34][cH:35][c:36]1[P:37]([c:38]1[o:39][cH:40][cH:41][cH:42]1)[c:43]1[o:44][cH:45][cH:46][cH:47]1>>[CH3:12][n:13]1[c:14](=[O:21])[c:15](-[c:64]2[cH:63][cH:62][c:61]([CH2:60][CH:51]([C:50]([O:49][CH3:48])=[O:68])[NH:52][C:53](=[O:54])[O:55][C:56]([CH3:57])([CH3:58])[CH3:59])[cH:66][cH:65]2)[c:16]([CH3:19])[cH:17][cH:18]1

Participants

12

Reactant 11

HCID 223AmmoniumHCID 312ChlorideHCID 6325EthyleneHCID 6397ChlorotrimethylsilaneHCID 78391,2-DibromoethaneHCID 8028TetrahydrofuranHCID 23994ZincHCID 521585Tris(furan-2-yl)phosphaneHCID 13875796(+-)-(R/S)-2-tert-Butoxycarbonylamino-3-(4-iodo-phenyl)-propionic acid methyl esterHCID 223820181,4-dimethyl-3-iodo-2(1H)-pyridoneHCID 223820251,4-dimethyl-5-iodo-2(1H)-pyridone

Product 1

HCID 21334949Methyl 3-[4-(1,4-dimethyl-2-oxo-3-pyridinyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Sources & evidence

ORD record
ord-d944892f3911419aa6d2a96741001bf5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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