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Dimethyl Sulfoxide → 1,1-Dimethylethyl 7-Iodo-8-({5-[(methylamino)carbonyl]-2-pyridinyl}oxy)-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate

HRID 182529
Notes
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Reaction equation

HRID 182529 reaction equation
[CH3:34][S:35](=[O:36])[CH3:37].[Cl:23][c:24]1[n:25][cH:26][c:27]([C:28](=[O:29])[NH:30][CH3:31])[cH:32][cH:33]1.[Cl:39][CH2:40][Cl:41].[H-:1].[Na+:2].[OH2:38].[OH:3][c:4]1[cH:5][c:6]2[c:7]([cH:20][c:21]1[I:22])[CH2:8][CH2:9][N:10]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH2:11][CH2:12]2>>[O:3]([c:4]1[cH:5][c:6]2[c:7]([cH:20][c:21]1[I:22])[CH2:8][CH2:9][N:10]([C:13](=[O:14])[O:15][C:16]([CH3:17])([CH3:18])[CH3:19])[CH2:11][CH2:12]2)[c:24]1[n:25][cH:26][c:27]([C:28](=[O:29])[NH:30][CH3:31])[cH:32][cH:33]1
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 679Dimethyl SulfoxideHCID 923Sodium IonHCID 962WaterHCID 6344DichloromethaneHCID 166653HydrideHCID 123642306-Chloro-N-methylnicotinamideHCID 592579221,1-dimethylethyl 7-hydroxy-8-iodo-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate

Product 1

HCID 574402891,1-Dimethylethyl 7-Iodo-8-({5-[(methylamino)carbonyl]-2-pyridinyl}oxy)-1,2,4,5-tetrahydro-3H-3-benzazepine-3-carboxylate

Sources & evidence

ORD record
ord-22495e302eb243d1a287fa87adc80f93
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes