3-(2-fluoro-1-fluoromethyl-ethyl)-8-methoxy-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-ylamine → N-[2-[[5-chloro-2-[[3-(1,3-difluoropropan-2-yl)-7-methoxy-1,2,4,5-tetrahydro-3-benzazepin-8-yl]amino]pyrimidin-4-yl]amino]cyclohexyl]methanesulfonamide

HRID 1125103Notes

Reaction equation

HRID 1125103 reaction equation
[Cl:20][c:21]1[n:22][cH:23][c:24]([Cl:39])[c:25]([NH:27][CH:28]2[CH:29]([NH:34][S:35](=[O:36])(=[O:37])[CH3:38])[CH2:30][CH2:31][CH2:32][CH2:33]2)[n:26]1.[F:1][CH2:2][CH:3]([CH2:4][F:5])[N:6]1[CH2:7][CH2:8][c:9]2[c:10]([cH:13][c:14]([NH2:19])[c:15]([O:17][CH3:18])[cH:16]2)[CH2:11][CH2:12]1>>[F:1][CH2:2][CH:3]([CH2:4][F:5])[N:6]1[CH2:7][CH2:8][c:9]2[c:10]([cH:13][c:14]([NH:19][c:21]3[n:22][cH:23][c:24]([Cl:39])[c:25]([NH:27][CH:28]4[CH:29]([NH:34][S:35](=[O:36])(=[O:37])[CH3:38])[CH2:30][CH2:31][CH2:32][CH2:33]4)[n:26]3)[c:15]([O:17][CH3:18])[cH:16]2)[CH2:11][CH2:12]1

Participants

3

Reactant 2

HCID 672643293-(2-fluoro-1-fluoromethyl-ethyl)-8-methoxy-2,3,4,5-tetrahydro-1H-benzo[d]azepin-7-ylamineHCID 86633859N-[2-(2,5-dichloro-pyrimidin-4-ylamino)-cyclohexyl]-methanesulfonamide

Product 1

HCID 178486455N-[2-[[5-chloro-2-[[3-(1,3-difluoropropan-2-yl)-7-methoxy-1,2,4,5-tetrahydro-3-benzazepin-8-yl]amino]pyrimidin-4-yl]amino]cyclohexyl]methanesulfonamide

Sources & evidence

ORD record
ord-ba8d1a539a4c4831ae4b5f4e08ab2b2d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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