2-(8-Amino-1-ethyl-7-methoxy-2-oxo-1,2,3,5-tetrahydro-benzo[e][1,4]diazepin-4-yl)-N,N-dimethyl-acetamide → 2-{8-[5-Chloro-4-(2-methoxy-4-morpholin-4-yl-phenylamino)-pyrimidin-2-ylamino]-1-ethyl-7-methoxy-2-oxo-1,2,3,5-tetrahydro-benzo[e][1,4]diazepin-4-yl}-N,N-dimethyl-acetamide

HRID 189577Notes

Reaction equation

HRID 189577 reaction equation
[Cl:24][c:25]1[n:26][cH:27][c:28]([Cl:46])[c:29]([NH:31][c:32]2[c:33]([O:44][CH3:45])[cH:34][c:35]([N:38]3[CH2:39][CH2:40][O:41][CH2:42][CH2:43]3)[cH:36][cH:37]2)[n:30]1.[NH2:1][c:2]1[c:3]([O:22][CH3:23])[cH:4][c:5]2[c:6]([cH:21]1)[N:7]([CH2:19][CH3:20])[C:8](=[O:18])[CH2:9][N:10]([CH2:12][C:13](=[O:14])[N:15]([CH3:16])[CH3:17])[CH2:11]2>>[NH:1]([c:2]1[c:3]([O:22][CH3:23])[cH:4][c:5]2[c:6]([cH:21]1)[N:7]([CH2:19][CH3:20])[C:8](=[O:18])[CH2:9][N:10]([CH2:12][C:13](=[O:14])[N:15]([CH3:16])[CH3:17])[CH2:11]2)[c:25]1[n:26][cH:27][c:28]([Cl:46])[c:29]([NH:31][c:32]2[c:33]([O:44][CH3:45])[cH:34][c:35]([N:38]3[CH2:39][CH2:40][O:41][CH2:42][CH2:43]3)[cH:36][cH:37]2)[n:30]1

Participants

3

Reactant 2

HCID 672637282-(8-Amino-1-ethyl-7-methoxy-2-oxo-1,2,3,5-tetrahydro-benzo[e][1,4]diazepin-4-yl)-N,N-dimethyl-acetamideHCID 86633851(2,5-Dichloropyrimidin-4-yl)-(2-methoxy-4-morpholin-4-yl-phenyl)-amine

Product 1

HCID 668305382-{8-[5-Chloro-4-(2-methoxy-4-morpholin-4-yl-phenylamino)-pyrimidin-2-ylamino]-1-ethyl-7-methoxy-2-oxo-1,2,3,5-tetrahydro-benzo[e][1,4]diazepin-4-yl}-N,N-dimethyl-acetamide

Sources & evidence

ORD record
ord-7ad64181d5a44927aece235abd073e19
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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