Chloride → 3-Benzyloxycarbonylamino-1-isobutyl-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one

HRID 199831Notes

Reaction equation

HRID 199831 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]1[C:13](=[O:29])[NH:14][c:15]2[c:16]([cH:25][cH:26][cH:27][cH:28]2)[C:17]([c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)=[N:18]1.[CH2:32]([CH:33]([CH3:34])[CH3:35])[I:36].[CH2:44]([Cl:45])[Cl:46].[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[Cl-:38].[H-:30].[Na+:31].[Na+:37]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[NH:11][CH:12]1[C:13](=[O:29])[N:14]([CH2:32][CH:33]([CH3:34])[CH3:35])[c:15]2[c:16]([cH:25][cH:26][cH:27][cH:28]2)[C:17]([c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)=[N:18]1

Participants

8

Reactant 7

HCID 312ChlorideHCID 923Sodium ion2×HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 10556Isobutyl iodideHCID 166653HydrideHCID 2756242Benzyl (2-oxo-5-phenyl-2,3-dihydro-1h-benzo[e][1,4]diazepin-3-yl)carbamate

Product 1

HCID 184442513-Benzyloxycarbonylamino-1-isobutyl-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one

Sources & evidence

ORD record
ord-89c52da260134437a34d599bd67c5036
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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