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Hydrochloric Acid → 3-[5-bromo-6-oxo-4-[(2,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)amino]pyridazin-1-yl]-N-(1-phenylethyl)propanamide

HRID 1117796
Notes
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Reaction equation

HRID 1117796 reaction equation
[Br:1][c:2]1[c:3]([NH:14][CH:15]2[CH:16]([CH3:24])[CH:17]3[C:18]([CH3:22])([CH3:23])[CH:19]([CH2:20]2)[CH2:21]3)[cH:4][n:5][n:6]([CH2:9][CH2:10][C:11](=[O:12])[OH:13])[c:7]1=[O:8].[CH3:26][N:27]([CH3:28])[CH2:29][CH2:30][CH2:31][N:32]=[C:33]=[N:34][CH2:35][CH3:36].[CH3:37][CH2:38][N:39]([CH2:40][CH3:41])[CH2:42][CH3:43].[CH3:44][CH:45]([NH2:46])[c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[CH3:53][N:54]([CH3:55])[CH:56]=[O:57].[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[ClH:25]>>[Br:1][c:2]1[c:3]([NH:14][CH:15]2[CH:16]([CH3:24])[CH:17]3[C:18]([CH3:22])([CH3:23])[CH:19]([CH2:20]2)[CH2:21]3)[cH:4][n:5][n:6]([CH2:9][CH2:10][C:11](=[O:12])[NH:46][CH:45]([CH3:44])[c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:7]1=[O:8]
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 74081-PhenethylamineHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 178430037HCID 178430037, compound

Product 1

HCID 1784651203-[5-bromo-6-oxo-4-[(2,6,6-trimethyl-3-bicyclo[3.1.1]heptanyl)amino]pyridazin-1-yl]-N-(1-phenylethyl)propanamide

Sources & evidence

ORD record
ord-b3c3103dbd98400faef0eac7ffffb2e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes