Cis tert-Butyl 4-aminocyclohexylcarbamate → cis-(4-{[4-(2-Cyclopropylmethoxy-4-methoxy-phenyl)-5H-pyrrolo[3,2-d]pyrimidine-7-carbonyl]-amino}-cyclohexyl)-carbamic acid tert-butyl ester

HRID 108799Notes

Reaction equation

HRID 108799 reaction equation
[C:26]([CH3:27])([CH3:28])([CH3:29])[O:30][C:31]([NH:32][CH:33]1[CH2:34][CH2:35][CH:36]([NH2:39])[CH2:37][CH2:38]1)=[O:40].[CH:1]1([CH2:4][O:5][c:6]2[c:7](-[c:14]3[c:15]4[c:16]([n:17][cH:18][n:19]3)[c:20]([C:23](=[O:24])[OH:25])[cH:21][nH:22]4)[cH:8][cH:9][c:10]([O:12][CH3:13])[cH:11]2)[CH2:2][CH2:3]1>>[CH:1]1([CH2:4][O:5][c:6]2[c:7](-[c:14]3[c:15]4[c:16]([n:17][cH:18][n:19]3)[c:20]([C:23](=[O:25])[NH:39][CH:36]3[CH2:35][CH2:34][CH:33]([NH:32][C:31]([O:30][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:40])[CH2:38][CH2:37]3)[cH:21][nH:22]4)[cH:8][cH:9][c:10]([O:12][CH3:13])[cH:11]2)[CH2:2][CH2:3]1

Participants

3

Reactant 2

HCID 2756050Cis tert-Butyl 4-aminocyclohexylcarbamateHCID 668660964-(2-Cyclopropylmethoxy-4-methoxy-phenyl)-5H-pyrrolo[3,2-d]pyrimidine-7-carboxylic acid

Product 1

HCID 66867313cis-(4-{[4-(2-Cyclopropylmethoxy-4-methoxy-phenyl)-5H-pyrrolo[3,2-d]pyrimidine-7-carbonyl]-amino}-cyclohexyl)-carbamic acid tert-butyl ester

Sources & evidence

ORD record
ord-ab64b4baaebd47a895ac9556f6042f48
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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