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Water → t-butyl 4-[7-(2-butynyl)-2-cyano-1-methyl-6-oxo-6,7-dihydro-1H-purin-8-yl]piperazine-1-carboxylate

HRID 147205
Notes
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Reaction equation

HRID 147205 reaction equation
[CH2:1]([C:2]#[C:3][CH3:4])[n:5]1[c:6]([N:17]2[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]2)[n:7][c:8]2[n:9][c:10]([Cl:16])[n:11]([CH3:15])[c:12](=[O:14])[c:13]12.[CH3:34][N:35]1[CH2:36][CH2:37][CH2:38][C:39]1=[O:40].[Na:30][C:31]#[N:32].[OH2:33]>>[CH2:1]([C:2]#[C:3][CH3:4])[n:5]1[c:6]([N:17]2[CH2:18][CH2:19][N:20]([C:23](=[O:24])[O:25][C:26]([CH3:27])([CH3:28])[CH3:29])[CH2:21][CH2:22]2)[n:7][c:8]2[n:9][c:10]([C:31]#[N:32])[n:11]([CH3:15])[c:12](=[O:14])[c:13]12
ParticipantsSources & evidenceReaction notes

Participants

5

Reactant 4

HCID 962WaterHCID 13387N-methyl-2-pyrrolidoneHCID 23070741t-butyl 4-(7-(2-butynyl)-2-chloro-1-methyl-6-oxo-6,7-dihydro-1H-purin-8-yl]piperazine-1-carboxylateHCID 178511850HCID 178511850, compound

Product 1

HCID 23070915t-butyl 4-[7-(2-butynyl)-2-cyano-1-methyl-6-oxo-6,7-dihydro-1H-purin-8-yl]piperazine-1-carboxylate

Sources & evidence

ORD record
ord-39bf349976894d1ca49e938765b66aca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes