1,2-Dichloroethane → 5-Chloro-1H-indole-7-carboxylic acid (4-tert-butyl-benzyl)-[2-(4-fluoro-phenyl)-ethyl]-amide

HRID 210869

Reaction equation

HRID 210869 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:9][NH:10][CH2:11][CH2:12][c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[cH:20][cH:21]1.[CH2:35]([Cl:36])[CH2:37][Cl:38].[Cl:22][c:23]1[cH:24][c:25]2[cH:26][cH:27][nH:28][c:29]2[c:30]([C:32](=[O:33])[OH:34])[cH:31]1.[Cl:40][CH2:41][Cl:42].[ClH:39]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:9][N:10]([CH2:11][CH2:12][c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[C:32]([c:30]2[c:29]3[c:25]([cH:24][c:23]([Cl:22])[cH:31]2)[cH:26][cH:27][nH:28]3)=[O:33])[cH:20][cH:21]1

Participants

6

Reactant 5

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 29280418(4-Tert-butyl-benzyl)-[2-(4-fluoro-phenyl)-ethyl]-amineHCID 668685635-chloro-1H-indole-7-carboxylic acid

Product 1

HCID 866031365-Chloro-1H-indole-7-carboxylic acid (4-tert-butyl-benzyl)-[2-(4-fluoro-phenyl)-ethyl]-amide

Sources & evidence

ORD record
ord-2acdd6cb65834811b105895476432f57
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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