proline dl-form → 2,5-Dichloro-4-[3-(4-cyclopropyl-3,4-dihydro-2H-quinoxaline-1-carbonyl)-pyridin-4-yloxy]-benzonitrile

HRID 693911Notes

Reaction equation

HRID 693911 reaction equation
[Br:1][c:2]1[cH:3][c:4]([Cl:31])[c:5]([O:6][c:7]2[c:8]([C:13](=[O:14])[N:15]3[CH2:16][CH2:17][N:18]([CH:25]4[CH2:26][CH2:27]4)[c:19]4[cH:20][cH:21][cH:22][cH:23][c:24]43)[cH:9][n:10][cH:11][cH:12]2)[cH:28][c:29]1[Cl:30].[CH3:44][N:45]([CH3:46])[CH:47]=[O:48].[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[Cu:40][C:41]#[N:42].[OH2:43].[OH:32][C:33]([CH:34]1[CH2:36][CH2:35][CH2:38][NH:39]1)=[O:37]>>[c:2]1([C:38]#[N:39])[cH:3][c:4]([Cl:31])[c:5]([O:6][c:7]2[c:8]([C:13](=[O:14])[N:15]3[CH2:16][CH2:17][N:18]([CH:25]4[CH2:26][CH2:27]4)[c:19]4[cH:20][cH:21][cH:22][cH:23][c:24]43)[cH:9][n:10][cH:11][cH:12]2)[cH:28][c:29]1[Cl:30]

Participants

7

Reactant 6

HCID 614proline dl-formHCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 53312111[4-(4-Bromo-2,5-dichloro-phenoxy)-pyridin-3-yl]-(4-cyclopropyl-3,4-dihydro-2H-quinoxalin-1-yl)-methanoneHCID 178418546HCID 178418546, compound

Product 1

HCID 533112742,5-Dichloro-4-[3-(4-cyclopropyl-3,4-dihydro-2H-quinoxaline-1-carbonyl)-pyridin-4-yloxy]-benzonitrile

Sources & evidence

ORD record
ord-637df4ca2ec2407d97c8f5b2291598b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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