Diethyl Ether → (10,11-Dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-yl)-[2-chloro-4-(cyclohex-1-en-1-yl)-phenyl]-methanone

HRID 1127930Notes

Reaction equation

HRID 1127930 reaction equation
[CH3:47][CH2:48][O:49][CH2:50][CH3:51].[F:33][C:34]([F:35])([F:36])[S:37]([O:38][C:39]1=[CH:40][CH2:41][CH2:42][CH2:43][CH2:44]1)(=[O:45])=[O:46].[cH:1]1[cH:2][cH:3][n:4]2[c:5]1[CH2:6][N:7]([C:15](=[O:16])[c:17]1[c:18]([Cl:32])[cH:19][c:20]([B:23]3[O:24][C:25]([CH3:26])([CH3:27])[C:28]([CH3:29])([CH3:30])[O:31]3)[cH:21][cH:22]1)[c:8]1[c:9]([cH:11][cH:12][cH:13][cH:14]1)[CH2:10]2>>[cH:1]1[cH:2][cH:3][n:4]2[c:5]1[CH2:6][N:7]([C:15](=[O:16])[c:17]1[c:18]([Cl:32])[cH:19][c:20]([C:39]3=[CH:40][CH2:41][CH2:42][CH2:43][CH2:44]3)[cH:21][cH:22]1)[c:8]1[c:9]([cH:11][cH:12][cH:13][cH:14]1)[CH2:10]2

Participants

4

Reactant 3

HCID 3283Diethyl EtherHCID 3194401-Cyclohexenyl trifluoromethanesulfonateHCID 22219716(10,11-Dihydro-5H-pyrrolo[2,1-c](1,4]benzodiazepin-10-yl)-[2-chloro-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-methanone

Product 1

HCID 22219697(10,11-Dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-yl)-[2-chloro-4-(cyclohex-1-en-1-yl)-phenyl]-methanone

Sources & evidence

ORD record
ord-68456bcfa4ba4dbb870bdd2a9475bbe3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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