7-Amino-3-ethyl-8-methoxy-1,3,4,5-tetrahydro-benzo[d]azepin-2-one → 7-{5-Chloro-4-[2-methoxy-4-(4-methyl-piperazin-1-yl)-phenylamino]-pyrimidin-2-ylamino}-3-ethyl-8-methoxy-1,3,4,5-tetrahydro-benzo[d]azepin-2-one

HRID 108819Notes

Reaction equation

HRID 108819 reaction equation
[Cl:18][c:19]1[n:20][cH:21][c:22]([Cl:41])[c:23]([NH:25][c:26]2[c:27]([O:39][CH3:40])[cH:28][c:29]([N:32]3[CH2:33][CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]3)[cH:30][cH:31]2)[n:24]1.[NH2:1][c:2]1[cH:3][c:4]2[c:5]([cH:14][c:15]1[O:16][CH3:17])[CH2:6][C:7](=[O:13])[N:8]([CH2:11][CH3:12])[CH2:9][CH2:10]2>>[NH:1]([c:2]1[cH:3][c:4]2[c:5]([cH:14][c:15]1[O:16][CH3:17])[CH2:6][C:7](=[O:13])[N:8]([CH2:11][CH3:12])[CH2:9][CH2:10]2)[c:19]1[n:20][cH:21][c:22]([Cl:41])[c:23]([NH:25][c:26]2[c:27]([O:39][CH3:40])[cH:28][c:29]([N:32]3[CH2:33][CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]3)[cH:30][cH:31]2)[n:24]1

Participants

3

Reactant 2

HCID 672634417-Amino-3-ethyl-8-methoxy-1,3,4,5-tetrahydro-benzo[d]azepin-2-oneHCID 86633904HCID 86633904, compound

Product 1

HCID 672641357-{5-Chloro-4-[2-methoxy-4-(4-methyl-piperazin-1-yl)-phenylamino]-pyrimidin-2-ylamino}-3-ethyl-8-methoxy-1,3,4,5-tetrahydro-benzo[d]azepin-2-one

Sources & evidence

ORD record
ord-196551ae157744efac5109536bdb1fd5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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