1,2-Diaminocyclohexane → 1-{6-[(3-Cyclobutyl-2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)oxy]-3-pyridinyl}-2-azetidinone

HRID 309052Notes

Reaction equation

HRID 309052 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[CH:12]1([N:16]2[CH2:17][CH2:18][c:19]3[c:20]([cH:23][cH:24][c:25]([O:27][c:28]4[n:29][cH:30][c:31]([I:34])[cH:32][cH:33]4)[cH:26]3)[CH2:21][CH2:22]2)[CH2:13][CH2:14][CH2:15]1.[Cs+:5].[Cs+:6].[Cu:49][I:50].[NH2:35][CH:36]1[CH2:37][CH2:38][CH2:39][CH2:40][CH:41]1[NH2:42].[NH:7]1[C:8](=[O:11])[CH2:9][CH2:10]1.[O:43]1[CH2:44][CH2:45][O:46][CH2:47][CH2:48]1>>[N:7]1([c:31]2[cH:30][n:29][c:28]([O:27][c:25]3[cH:24][cH:23][c:20]4[c:19]([cH:26]3)[CH2:18][CH2:17][N:16]([CH:12]3[CH2:13][CH2:14][CH2:15]3)[CH2:22][CH2:21]4)[cH:33][cH:32]2)[C:8](=[O:11])[CH2:9][CH2:10]1

Participants

8

Reactant 7

HCID 46101,2-DiaminocyclohexaneHCID 19660Carbonate IonHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 1367212-AzetidinoneHCID 574402941H-3-Benzazepine, 3-cyclobutyl-2,3,4,5-tetrahydro-7-[(5-iodo-2-pyridinyl)oxy]-

Product 1

HCID 103613561-{6-[(3-Cyclobutyl-2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)oxy]-3-pyridinyl}-2-azetidinone

Sources & evidence

ORD record
ord-55799613780045478c42d41c3690ca1e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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