1-(Trifluoromethylsulfonyloxy)-2,6-dimethyl-1-cyclohexene → (10,11-Dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-yl)-[4-(2,6-dimethyl-cyclohex-1-en-1-yl)-3-methyl-phenyl]-methanone

HRID 114138Notes

Reaction equation

HRID 114138 reaction equation
[F:33][C:34]([F:35])([F:36])[S:37]([O:38][C:39]1=[C:40]([CH3:46])[CH2:41][CH2:42][CH2:43][CH:44]1[CH3:45])(=[O:47])=[O:48].[cH:1]1[cH:2][cH:3][n:4]2[c:5]1[CH2:6][N:7]([C:15](=[O:16])[c:17]1[cH:18][c:19]([CH3:32])[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[cH:18][c:19]([CH3:32])[c:20]([C:39]3=[C:40]([CH3:46])[CH2:41][CH2:42][CH2:43][CH:44]3[CH3:45])[cH:21][cH:22]1)[c:8]1[c:9]([cH:11][cH:12][cH:13][cH:14]1)[CH2:10]2

Participants

3

Reactant 2

HCID 125721641-(Trifluoromethylsulfonyloxy)-2,6-dimethyl-1-cyclohexeneHCID 22219714(10,11-Dihydro-5H-pyrrolo [2,1-c][1,4] benzodiazepin-10-yl)-[3-methyl-4-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-methanone

Product 1

HCID 10223296(10,11-Dihydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-10-yl)-[4-(2,6-dimethyl-cyclohex-1-en-1-yl)-3-methyl-phenyl]-methanone

Sources & evidence

ORD record
ord-440de200983046278895aeee66e3efea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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