2-chloro-N-(8-fluoro-3,4-dihydro-2H-chromen-4-yl)-5-nitropyrimidin-4-amine → 2-N-[2-[(2,4-dimethoxyphenyl)methylamino]-4-fluorophenyl]-4-N-(8-fluoro-3,4-dihydro-2H-chromen-4-yl)-5-nitropyrimidine-2,4-diamine

HRID 170615Notes

Reaction equation

HRID 170615 reaction equation
[CH3:23][O:24][c:25]1[c:26]([CH2:27][NH:28][c:29]2[c:30]([NH2:36])[cH:31][cH:32][c:33]([F:35])[cH:34]2)[cH:37][cH:38][c:39]([O:41][CH3:42])[cH:40]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([N+:20](=[O:21])[O-:22])[c:6]([NH:8][CH:9]2[CH2:10][CH2:11][O:12][c:13]3[c:14]([F:19])[cH:15][cH:16][cH:17][c:18]32)[n:7]1>>[c:2]1([NH:36][c:30]2[c:29]([NH:28][CH2:27][c:26]3[c:25]([O:24][CH3:23])[cH:40][c:39]([O:41][CH3:42])[cH:38][cH:37]3)[cH:34][c:33]([F:35])[cH:32][cH:31]2)[n:3][cH:4][c:5]([N+:20](=[O:21])[O-:22])[c:6]([NH:8][CH:9]2[CH2:10][CH2:11][O:12][c:13]3[c:14]([F:19])[cH:15][cH:16][cH:17][c:18]32)[n:7]1

Participants

3

Reactant 2

HCID 597268842-chloro-N-(8-fluoro-3,4-dihydro-2H-chromen-4-yl)-5-nitropyrimidin-4-amineHCID 59726916N1-(2,4-dimethoxybenzyl)-5-fluorobenzene-1,2-diamine

Product 1

HCID 597271282-N-[2-[(2,4-dimethoxyphenyl)methylamino]-4-fluorophenyl]-4-N-(8-fluoro-3,4-dihydro-2H-chromen-4-yl)-5-nitropyrimidine-2,4-diamine

Sources & evidence

ORD record
ord-45ed01c0dbae4301830932c0bf470091
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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