(2-Ethoxy-5-oxo-tetrahydrofuran-3-yl)-carbamic acid allyl ester → 1-[2-(4-Amino-3,5-dichloro-benzoylamino)-propionyl]-pyrrolidine-2-carboxylic acid (2-ethoxy-5-oxo-tetrahydro-furan-3-yl)-amide

HRID 307422Notes

Reaction equation

HRID 307422 reaction equation
[C:17]([O:18][C:19](=[O:20])[CH:24]1[N:25]([C:29]([CH:30]([CH3:31])[NH:32][C:33]([c:34]2[cH:35][c:36]([Cl:42])[c:37]([NH2:41])[c:38]([Cl:40])[cH:39]2)=[O:43])=[O:44])[CH2:26][CH2:27][CH2:28]1)([CH3:21])([CH3:22])[CH3:23].[CH2:1]([O:2][C:5]([NH:6][CH:7]1[CH:8]([O:13][CH2:14][CH3:15])[O:9][C:10](=[O:12])[CH2:11]1)=[O:16])[CH:3]=[CH2:4].[O:45]=[C:46]1[O:47][CH:48]([O:49][CH2:50][CH2:51][c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[CH:58]([NH:59][C:60]([CH:61]2[CH2:62][CH2:63][CH2:64][N:65]2[C:66](=[O:67])[CH:68]([NH:69][C:70](=[O:71])[c:72]2[cH:73][cH:74][c:75]([NH2:76])[c:77]([Cl:78])[cH:79]2)[CH3:80])=[O:81])[CH2:82]1>>[C:5]([NH:6][CH:7]1[CH:8]([O:13][CH2:14][CH3:15])[O:9][C:10](=[O:12])[CH2:11]1)(=[O:16])[CH:24]1[N:25]([C:29]([CH:30]([CH3:31])[NH:32][C:33]([c:34]2[cH:35][c:36]([Cl:42])[c:37]([NH2:41])[c:38]([Cl:40])[cH:39]2)=[O:43])=[O:44])[CH2:26][CH2:27][CH2:28]1

Participants

4

Reactant 3

HCID 22149038(2-Ethoxy-5-oxo-tetrahydrofuran-3-yl)-carbamic acid allyl esterHCID 229775121-[2-(4-Amino-3-chloro-benzoylamino)-propionyl]-pyrrolidine-2-carboxylic acid (5-oxo-2-phenethyloxy-tetrahydro-furan-3-yl)-amideHCID 689509841-[2-(4-Amino-3,5-dichloro-benzoylamino)-propionyl]-pyrrolidine-2-carboxylic acid tert-butyl ester

Product 1

HCID 229774911-[2-(4-Amino-3,5-dichloro-benzoylamino)-propionyl]-pyrrolidine-2-carboxylic acid (2-ethoxy-5-oxo-tetrahydro-furan-3-yl)-amide

Sources & evidence

ORD record
ord-3b588382ae51412082f7555de1f96a00
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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