tert-butyl N-(pyrrolidin-3-yl)carbamate → (1-(7-(2-Cyanobenzyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-8-yl)pyrrolidin-3-yl)carbamic acid tert-butyl ester

HRID 296298Notes

Reaction equation

HRID 296298 reaction equation
[C:24]([CH3:25])([CH3:26])([CH3:27])[O:28][C:29](=[O:30])[NH:31][CH:32]1[CH2:33][NH:34][CH2:35][CH2:36]1.[Cl:1][c:2]1[n:3][c:4]2[n:5]([CH3:23])[c:6](=[O:22])[n:7]([CH3:21])[c:8](=[O:20])[c:9]2[n:10]1[CH2:11][c:12]1[c:13]([C:14]#[N:15])[cH:16][cH:17][cH:18][cH:19]1>>[c:2]1([N:34]2[CH2:33][CH:32]([NH:31][C:29]([O:28][C:24]([CH3:25])([CH3:26])[CH3:27])=[O:30])[CH2:36][CH2:35]2)[n:3][c:4]2[n:5]([CH3:23])[c:6](=[O:22])[n:7]([CH3:21])[c:8](=[O:20])[c:9]2[n:10]1[CH2:11][c:12]1[c:13]([C:14]#[N:15])[cH:16][cH:17][cH:18][cH:19]1

Participants

3

Reactant 2

HCID 2757234tert-butyl N-(pyrrolidin-3-yl)carbamateHCID 88509802-(8-Chloro-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-ylmethyl)benzonitrile

Product 1

HCID 69136322(1-(7-(2-Cyanobenzyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-8-yl)pyrrolidin-3-yl)carbamic acid tert-butyl ester

Sources & evidence

ORD record
ord-00c9f113449845718dfbcb77843b1585
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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