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Acetonitrile → 7,8-Dimethoxy-1-methyl-5-(2-phenylethynyl)-1,3-dihydro-1,4-benzodiazepin-2-one

HRID 805439
Notes
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Reaction equation

HRID 805439 reaction equation
[CH3:46][C:47]#[N:48].[Cl:1][C:2]1=[N:3][CH2:4][C:5](=[O:18])[N:6]([CH3:17])[c:7]2[c:8]1[cH:9][c:10]([O:15][CH3:16])[c:11]([O:13][CH3:14])[cH:12]2.[Cu:52][I:53].[Pd:49]([Cl:50])[Cl:51].[c:19]1([P:20]([c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:33][cH:34][cH:35][cH:36][cH:37]1.[c:38]1([C:44]#[CH:45])[cH:39][cH:40][cH:41][cH:42][cH:43]1>>[C:2]1([C:45]#[C:44][c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)=[N:3][CH2:4][C:5](=[O:18])[N:6]([CH3:17])[c:7]2[c:8]1[cH:9][c:10]([O:15][CH3:16])[c:11]([O:13][CH3:14])[cH:12]2
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 6342AcetonitrileHCID 10821PhenylacetyleneHCID 11776TriphenylphosphineHCID 24290Palladium ChlorideHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 691548525-Chloro-7,8-dimethoxy-1-methyl-1,3-dihydro-1,4-benzodiazepin-2-one

Product 1

HCID 573973617,8-Dimethoxy-1-methyl-5-(2-phenylethynyl)-1,3-dihydro-1,4-benzodiazepin-2-one

Sources & evidence

ORD record
ord-3070e78beb2c4119a51c39f32ee4e629
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes