3-Oxo-3-(3-[1,2,3)triazol-1-yl-phenyl)-propionic acid ethyl ester → {4-Chloro-5-[(2-methoxy-ethyl)-methyl-amino]-2-[3-oxo-3-(3-[1,2,3]triazol-1-yl-phenyl)-propionylamino]-phenyl}-carbamic acid tert.-butyl ester

HRID 2124084Notes

Reaction equation

HRID 2124084 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH2:21])[cH:10][c:11]([Cl:20])[c:12]([N:14]([CH3:15])[CH2:16][CH2:17][O:18][CH3:19])[cH:13]1)=[O:22].[CH2:23]([O:25][C:26](=[O:24])[CH2:27][C:28]([c:29]1[cH:30][c:31](-[n:35]2[n:36][n:37][cH:38][cH:39]2)[cH:32][cH:33][cH:34]1)=[O:40])[CH3:41]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([NH:21][C:26](=[O:25])[CH2:27][C:28]([c:29]2[cH:30][c:31](-[n:35]3[n:36][n:37][cH:38][cH:39]3)[cH:32][cH:33][cH:34]2)=[O:40])[cH:10][c:11]([Cl:20])[c:12]([N:14]([CH3:15])[CH2:16][CH2:17][O:18][CH3:19])[cH:13]1)=[O:22]

Participants

3

Reactant 2

HCID 695928683-Oxo-3-(3-[1,2,3)triazol-1-yl-phenyl)-propionic acid ethyl esterHCID 69687800Carbamic acid,[2-amino-4-chloro-5-[(2-methoxyethyl)methylamino]phenyl]-,1,1-dimethylethyl ester

Product 1

HCID 86586811{4-Chloro-5-[(2-methoxy-ethyl)-methyl-amino]-2-[3-oxo-3-(3-[1,2,3]triazol-1-yl-phenyl)-propionylamino]-phenyl}-carbamic acid tert.-butyl ester

Sources & evidence

ORD record
ord-14353efee6f2432ebe09e5500db58103
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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