Nitrogen → 6-[2-chloro-1-(4-chlorophenyl)-1-(4-methyl-4H-1,2,4-triazol-3-yl)ethyl]-4-(3-chlorophenyl)-1-methyl-2(1H)-quinolinone

HRID 177156Notes

Reaction equation

HRID 177156 reaction equation
[CH3:40][O:41][CH2:42][CH2:43][O:44][CH3:45].[CH3:47][CH:48]([OH:49])[CH3:50].[Cl:36][CH2:37][Cl:38].[Cl:3][c:4]1[cH:5][c:6](-[c:10]2[cH:11][c:12](=[O:35])[n:13]([CH3:34])[c:14]3[cH:15][cH:16][c:17]([CH:20]([c:21]4[n:22][n:23][cH:24][n:25]4[CH3:26])[c:27]4[cH:28][cH:29][c:30]([Cl:33])[cH:31][cH:32]4)[cH:18][c:19]23)[cH:7][cH:8][cH:9]1.[K:39].[N:1]#[N:2].[OH2:46]>>[Cl:3][c:4]1[cH:5][c:6](-[c:10]2[cH:11][c:12](=[O:35])[n:13]([CH3:34])[c:14]3[cH:15][cH:16][c:17]([C:20]([c:21]4[n:22][n:23][cH:24][n:25]4[CH3:26])([c:27]4[cH:28][cH:29][c:30]([Cl:33])[cH:31][cH:32]4)[CH2:37][Cl:36])[cH:18][c:19]23)[cH:7][cH:8][cH:9]1

Participants

8

Reactant 7

HCID 947NitrogenHCID 962WaterHCID 3776IsopropanolHCID 6344DichloromethaneHCID 80711,2-DimethoxyethaneHCID 5462222PotassiumHCID 98910924-(3-chlorophenyl)-6-[(4-chlorophenyl)(4-methyl-4H-1,2,4-triazol-3-yl)methyl]-1-methyl-2(1H)-quinolinone

Product 1

HCID 210820746-[2-chloro-1-(4-chlorophenyl)-1-(4-methyl-4H-1,2,4-triazol-3-yl)ethyl]-4-(3-chlorophenyl)-1-methyl-2(1H)-quinolinone

Sources & evidence

ORD record
ord-e3c14f5aca004ea7847d7829646974f4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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