1-(8-Amino-2,3,4,5-tetrahydro-5,5-dimethylbenzo[b]azepin-1-yl)ethanone → 1-{8-[5-Chloro-4-(2-methoxy-4-morpholin-4-yl-phenylamino)-pyrimidin-2-ylamino]-5,5-dimethyl-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl}-ethanone

HRID 300055Notes

Reaction equation

HRID 300055 reaction equation
[Cl:18][c:19]1[n:20][cH:21][c:22]([Cl:40])[c:23]([NH:25][c:26]2[c:27]([O:38][CH3:39])[cH:28][c:29]([N:32]3[CH2:33][CH2:34][O:35][CH2:36][CH2:37]3)[cH:30][cH:31]2)[n:24]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:17]1)[N:7]([C:14]([CH3:15])=[O:16])[CH2:8][CH2:9][CH2:10][C:11]2([CH3:12])[CH3:13]>>[NH:1]([c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:17]1)[N:7]([C:14]([CH3:15])=[O:16])[CH2:8][CH2:9][CH2:10][C:11]2([CH3:12])[CH3:13])[c:19]1[n:20][cH:21][c:22]([Cl:40])[c:23]([NH:25][c:26]2[c:27]([O:38][CH3:39])[cH:28][c:29]([N:32]3[CH2:33][CH2:34][O:35][CH2:36][CH2:37]3)[cH:30][cH:31]2)[n:24]1

Participants

3

Reactant 2

HCID 578647161-(8-Amino-2,3,4,5-tetrahydro-5,5-dimethylbenzo[b]azepin-1-yl)ethanoneHCID 86633851(2,5-Dichloropyrimidin-4-yl)-(2-methoxy-4-morpholin-4-yl-phenyl)-amine

Product 1

HCID 668301101-{8-[5-Chloro-4-(2-methoxy-4-morpholin-4-yl-phenylamino)-pyrimidin-2-ylamino]-5,5-dimethyl-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl}-ethanone

Sources & evidence

ORD record
ord-636e1560256842a48d9a5e01b42ed9d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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