4-[[2-(4-Tolyl)benzoyl)amino]benzoic acid → N-[4-(2-hydroxy-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]quinoxaline-5-carbonyl)phenyl]-2-(4-methylphenyl)benzamide

HRID 1135687Notes

Reaction equation

HRID 1135687 reaction equation
[OH:1][CH:2]1[CH2:3][CH:4]2[N:5]([c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]3[NH:12][CH2:13]2)[CH2:14]1.[c:15]1([CH3:39])[cH:16][cH:17][c:18](-[c:21]2[c:22]([C:23](=[O:24])[NH:25][c:26]3[cH:27][cH:28][c:29]([C:30](=[O:31])[OH:32])[cH:33][cH:34]3)[cH:35][cH:36][cH:37][cH:38]2)[cH:19][cH:20]1>>[OH:1][CH:2]1[CH2:3][CH:4]2[N:5]([c:6]3[cH:7][cH:8][cH:9][cH:10][c:11]3[N:12]([C:30]([c:29]3[cH:28][cH:27][c:26]([NH:25][C:23]([c:22]4[c:21](-[c:18]5[cH:17][cH:16][c:15]([CH3:39])[cH:20][cH:19]5)[cH:38][cH:37][cH:36][cH:35]4)=[O:24])[cH:34][cH:33]3)=[O:31])[CH2:13]2)[CH2:14]1

Participants

3

Reactant 2

HCID 155453824-[[2-(4-Tolyl)benzoyl)amino]benzoic acidHCID 219999341,2,3,3a,4,5-Hexahydropyrrolo[1,2-a]quinoxalin-2-ol

Product 1

HCID 21999918N-[4-(2-hydroxy-2,3,3a,4-tetrahydro-1H-pyrrolo[1,2-a]quinoxaline-5-carbonyl)phenyl]-2-(4-methylphenyl)benzamide

Sources & evidence

ORD record
ord-93746fe520c94fdf9078218473ec7616
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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