Dichloromethane → 4-Fluoro-3-[8-(2-fluorophenyl)-7-methoxy-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl]benzonitrile

HRID 934144Notes

Reaction equation

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

Participants

Reactant 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 86758251tert-butyl N-[2-[[3-(5-cyano-2-fluorophenyl)-3-oxopropanoyl]amino]-4-(2-fluorophenyl)-5-methoxyphenyl]carbamate

Product 1

HCID 224487244-Fluoro-3-[8-(2-fluorophenyl)-7-methoxy-2-oxo-1,3-dihydro-1,5-benzodiazepin-4-yl]benzonitrile

Sources & evidence

ORD record: ord-38fcfcbd77a744bf8e4cecbec47b41f7
Source dataset: Validation data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

Reaction notes

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