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Ammonium → 2-[2-(3,5-dimethylphenyl)-3-[2-[4-(pyridin-4-yl)butylamino]ethyl]-1H-indol-5-yl]-N,N-diethylisobutyramide

HRID 1135119
Notes
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Reaction equation

HRID 1135119 reaction equation
[BH4-:48].[CH3:55][OH:56].[Cl:52][CH2:53][Cl:54].[Mg+2:42].[NH2:1][CH2:2][CH2:3][c:4]1[c:5](-[c:23]2[cH:24][c:25]([CH3:30])[cH:26][c:27]([CH3:29])[cH:28]2)[nH:6][c:7]2[cH:8][cH:9][c:10]([C:13]([C:14](=[O:15])[N:16]([CH2:17][CH3:18])[CH2:19][CH3:20])([CH3:21])[CH3:22])[cH:11][c:12]12.[NH4+:51].[Na+:49].[O-:43][S:44](=[O:45])(=[O:46])[O-:47].[OH-:50].[n:31]1[cH:32][cH:33][c:34]([CH2:37][CH2:38][CH2:39][CH:40]=[O:41])[cH:35][cH:36]1>>[NH:1]([CH2:2][CH2:3][c:4]1[c:5](-[c:23]2[cH:24][c:25]([CH3:30])[cH:26][c:27]([CH3:29])[cH:28]2)[nH:6][c:7]2[cH:8][cH:9][c:10]([C:13]([C:14](=[O:15])[N:16]([CH2:17][CH3:18])[CH2:19][CH3:20])([CH3:21])[CH3:22])[cH:11][c:12]12)[CH2:40][CH2:39][CH2:38][CH2:37][c:34]1[cH:33][cH:32][n:31][cH:36][cH:35]1
ParticipantsSources & evidenceReaction notes

Participants

11

Reactant 10

HCID 223AmmoniumHCID 887MethanolHCID 888Magnesium CationHCID 923Sodium IonHCID 961HydroxideHCID 1117Sulfate IonHCID 6344DichloromethaneHCID 28123
Borohydride
HCID 114464344-Pyridin-4-ylbutanal
HCID 121499922-[3-(2-aminoethyl)-2-(3,5-dimethylphenyl)-1H-indol-5-yl]-N,N-diethylisobutyramide

Product 1

HCID 221009052-[2-(3,5-dimethylphenyl)-3-[2-[4-(pyridin-4-yl)butylamino]ethyl]-1H-indol-5-yl]-N,N-diethylisobutyramide

Sources & evidence

ORD record
ord-0347ab88db5d4b16bbbdc505df4193f1
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