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Water → N-tert-Butyl-3-((4-(4-(3-isobutylureido)-2-methoxybenzoyl)piperazin-1-yl)methyl)benzamide

HRID 946547
Notes
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Reaction equation

HRID 946547 reaction equation
[CH2:46]([CH:47]([CH3:48])[CH3:49])[NH2:50].[Cl:32][C:33](=[O:34])[OH:35].[Cl:51][CH2:52][Cl:53].[N+:36]([c:37]1[cH:38][cH:39][c:40]([OH:41])[cH:42][cH:43]1)([O-:44])=[O:45].[NH2:1][c:2]1[cH:3][c:4]([O:30][CH3:31])[c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH2:10][N:11]([CH2:14][c:15]3[cH:16][c:17]([C:18](=[O:19])[NH:20][C:21]([CH3:22])([CH3:23])[CH3:24])[cH:25][cH:26][cH:27]3)[CH2:12][CH2:13]2)[cH:28][cH:29]1.[OH2:54]>>[NH:1]([c:2]1[cH:3][c:4]([O:30][CH3:31])[c:5]([C:6](=[O:7])[N:8]2[CH2:9][CH2:10][N:11]([CH2:14][c:15]3[cH:16][c:17]([C:18](=[O:19])[NH:20][C:21]([CH3:22])([CH3:23])[CH3:24])[cH:25][cH:26][cH:27]3)[CH2:12][CH2:13]2)[cH:28][cH:29]1)[C:33](=[O:35])[NH:50][CH2:46][CH:47]([CH3:48])[CH3:49]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 962WaterHCID 9804-NitrophenolHCID 6344DichloromethaneHCID 6558IsobutylamineHCID 164602Chloroformic acidHCID 579176893-((4-(4-Amino-2-methoxybenzoyl)piperazin-1-yl)methyl)-N-tert-butylbenzamide

Product 1

HCID 57917622
N-tert-Butyl-3-((4-(4-(3-isobutylureido)-2-methoxybenzoyl)piperazin-1-yl)methyl)benzamide

Sources & evidence

ORD record
ord-bbebd6d39d874c1a8dafcba57e280aeb
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes