Water → 3-fluoro-1,3-dihydro-7-nitro-5-phenyl-2H-1,4-benzodiazepin-2-one

HRID 1546693Notes

Reaction equation

HRID 1546693 reaction equation
[CH2:23]([N:24]([S:25]([F:26])([F:27])[F:29])[CH2:28][CH3:30])[CH3:31].[CH2:33]([Cl:34])[Cl:35].[OH2:32].[OH:1][CH:2]1[C:3](=[O:22])[NH:4][c:5]2[c:6]([cH:15][c:16]([N+:19](=[O:20])[O-:21])[cH:17][cH:18]2)[C:7]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)=[N:8]1>>[CH:2]1([F:29])[C:3](=[O:22])[NH:4][c:5]2[c:6]([cH:15][c:16]([N+:19](=[O:20])[O-:21])[cH:17][cH:18]2)[C:7]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)=[N:8]1

Participants

5

Reactant 4

HCID 962WaterHCID 6344DichloromethaneHCID 123472(Diethylamino)sulfur trifluorideHCID 616119Nitroxazepam

Product 1

HCID 131259943-fluoro-1,3-dihydro-7-nitro-5-phenyl-2H-1,4-benzodiazepin-2-one

Sources & evidence

ORD record
ord-b780a090d92b4eba99bd47bb6e7a70ea
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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