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Acetic Acid → 6-[1-[3-(Ethylamino)-2-pyridyl]piperazin-4-yl-carbonyl]nicotinic acid methyl ester

HRID 88724
Notes
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Reaction equation

HRID 88724 reaction equation
[C:31]([BH3-:32])#[N:33].[CH3:1][O:2][C:3]([c:4]1[cH:5][n:6][c:7]([C:10](=[O:11])[N:12]2[CH2:13][CH2:14][N:15]([c:18]3[n:19][cH:20][cH:21][cH:22][c:23]3[NH2:24])[CH2:16][CH2:17]2)[cH:8][cH:9]1)=[O:25].[CH3:26][OH:27].[CH3:36][C:37](=[O:38])[OH:39].[CH:28]([CH3:29])=[O:30].[Na+:34].[OH2:35]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][n:6][c:7]([C:10](=[O:11])[N:12]2[CH2:13][CH2:14][N:15]([c:18]3[n:19][cH:20][cH:21][cH:22][c:23]3[NH:24][CH2:28][CH3:29])[CH2:16][CH2:17]2)[cH:8][cH:9]1)=[O:25]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 177AcetaldehydeHCID 887MethanolHCID 923Sodium IonHCID 962WaterHCID 498716Cyano-borohydrideHCID 206964266-[1-(3-Amino-2-pyridyl)piperazin-4-yl-carbonyl]nicotinic acid methyl ester

Product 1

On this pageParticipantsSources & evidenceReaction notes
HCID 702122536-[1-[3-(Ethylamino)-2-pyridyl]piperazin-4-yl-carbonyl]nicotinic acid methyl ester

Sources & evidence

ORD record
ord-34cb916823ac4c54ba8ebb3a85acd6ce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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