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Water → 1H-Indole-7-carboxylic acid (4-tert-butyl-benzyl)-[2-(3-chloro-phenyl)-ethyl]-amide

HRID 140922
Notes
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Reaction equation

HRID 140922 reaction equation
[B-:13]([F:14])([F:15])([F:16])[F:17].[C:44]([CH3:45])([CH3:46])([CH3:47])[c:48]1[cH:49][cH:50][c:51]([CH2:52][NH:53][CH2:54][CH2:55][c:56]2[cH:57][c:58]([Cl:62])[cH:59][cH:60][cH:61]2)[cH:63][cH:64]1.[CH:35]([N:36]([CH2:37][CH3:38])[CH:39]([CH3:40])[CH3:41])([CH3:42])[CH3:43].[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[OH2:70].[n:18]1([O:19][C:20]([N:21]([CH3:22])[CH3:23])=[N+:24]([CH3:25])[CH3:26])[c:27]2[cH:28][cH:29][cH:30][cH:31][c:32]2[n:33][n:34]1.[nH:1]1[cH:2][cH:3][c:4]2[cH:5][cH:6][cH:7][c:8]([C:10](=[O:11])[OH:12])[c:9]12>>[nH:1]1[cH:2][cH:3][c:4]2[cH:5][cH:6][cH:7][c:8]([C:10](=[O:12])[N:53]([CH2:52][c:51]3[cH:50][cH:49][c:48]([C:44]([CH3:45])([CH3:46])[CH3:47])[cH:64][cH:63]3)[CH2:54][CH2:55][c:56]3[cH:57][c:58]([Cl:62])[cH:59][cH:60][cH:61]3)[c:9]12
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 962WaterHCID 6228DimethylformamideHCID 26255TetrafluoroborateHCID 742811H-Indole-7-carboxylic acidHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 39425842
(4-Tert-butyl-benzyl)-[2-(3-chloro-phenyl)-ethyl]-amine

Product 1

HCID 866030601H-Indole-7-carboxylic acid (4-tert-butyl-benzyl)-[2-(3-chloro-phenyl)-ethyl]-amide

Sources & evidence

ORD record
ord-56b0de28c2f1494f8186f4751c153bbc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes