8-Amino-1-(2-methoxyethyl)-1,3,4,5-tetrahydrobenzo[b]azepin-2-one → 3-Fluoro-2-{2-[1-(2-methoxy-ethyl)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-8-ylamino]-5-trifluoromethyl-pyrimidin-4-ylamino]-N-methyl-benzamide

HRID 1210882Notes

Reaction equation

HRID 1210882 reaction equation
[Cl:1][c:2]1[n:3][cH:4][c:5]([C:20]([F:21])([F:22])[F:23])[c:6]([NH:8][c:9]2[c:10]([C:11](=[O:12])[NH:13][CH3:14])[cH:15][cH:16][cH:17][c:18]2[F:19])[n:7]1.[NH2:24][c:25]1[cH:26][cH:27][c:28]2[c:29]([cH:40]1)[N:30]([CH2:36][CH2:37][O:38][CH3:39])[C:31](=[O:35])[CH2:32][CH2:33][CH2:34]2>>[c:2]1([NH:24][c:25]2[cH:26][cH:27][c:28]3[c:29]([cH:40]2)[N:30]([CH2:36][CH2:37][O:38][CH3:39])[C:31](=[O:35])[CH2:32][CH2:33][CH2:34]3)[n:3][cH:4][c:5]([C:20]([F:21])([F:22])[F:23])[c:6]([NH:8][c:9]2[c:10]([C:11](=[O:12])[NH:13][CH3:14])[cH:15][cH:16][cH:17][c:18]2[F:19])[n:7]1

Participants

3

Reactant 2

HCID 672634528-Amino-1-(2-methoxyethyl)-1,3,4,5-tetrahydrobenzo[b]azepin-2-oneHCID 866339452-(2-chloro-5-trifluoromethyl-pyrimidin-4-ylamino)-3-fluoro-N-methyl-benzamide

Product 1

HCID 668304743-Fluoro-2-{2-[1-(2-methoxy-ethyl)-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-8-ylamino]-5-trifluoromethyl-pyrimidin-4-ylamino]-N-methyl-benzamide

Sources & evidence

ORD record
ord-5b46b90b042247daa421ae5a5f29fc15
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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