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Sodium Ion → 4-Methyl-3-(4-methylpiperazin-1-ylcarbonyl)-2-(3-nitrophenyl)-6-phenylpyridine

HRID 2321470
Notes
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Reaction equation

HRID 2321470 reaction equation
[CH2:39]([Cl:40])[Cl:41].[CH3:1][c:2]1[c:3]([C:23](=[O:24])[OH:25])[c:4](-[c:14]2[cH:15][c:16]([N+:20](=[O:21])[O-:22])[cH:17][cH:18][cH:19]2)[n:5][c:6](-[c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[cH:7]1.[CH3:30][N:31]1[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]1.[CH3:43][N:44]([CH3:45])[CH:46]=[O:47].[Na+:38].[OH-:37].[OH2:42].[S:26]([Cl:27])([Cl:28])=[O:29]>>[CH3:1][c:2]1[c:3]([C:23](=[O:25])[N:34]2[CH2:33][CH2:32][N:31]([CH3:30])[CH2:36][CH2:35]2)[c:4](-[c:14]2[cH:15][c:16]([N+:20](=[O:21])[O-:22])[cH:17][cH:18][cH:19]2)[n:5][c:6](-[c:8]2[cH:9][cH:10][cH:11][cH:12][cH:13]2)[cH:7]1
ParticipantsSources & evidenceReaction notes

Participants

9

Reactant 8

HCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 24386Thionyl ChlorideHCID 531671-Methylpiperazine
HCID 10359515
4-Methyl-2-(3-nitrophenyl)-6-phenyl-3-pyridinecarboxylic acid

Product 1

HCID 99793004-Methyl-3-(4-methylpiperazin-1-ylcarbonyl)-2-(3-nitrophenyl)-6-phenylpyridine

Sources & evidence

ORD record
ord-7b414631230745fcbadc0868df675ab5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes