1,2-Dichloroethane → HCID 21201828, compound

HRID 1535738Notes

Reaction equation

HRID 1535738 reaction equation
[CH3:22][C:23]([CH2:24][C:25](=[O:26])[Cl:27])([CH3:28])[CH3:29].[Cl:37][CH2:38][CH2:39][Cl:40].[O:1]=[C:2]1[CH:3]([NH:14][C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:4][NH:5][c:6]2[c:7]([cH:9][c:10]([CH3:13])[cH:11][cH:12]2)[NH:8]1.[OH2:36].[cH:30]1[cH:31][cH:32][n:33][cH:34][cH:35]1>>[O:1]=[C:2]1[CH:3]([NH:14][C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:4][N:5]([C:25]([CH2:24][C:23]([CH3:22])([CH3:28])[CH3:29])=[O:26])[c:6]2[c:7]([cH:9][c:10]([CH3:13])[cH:11][cH:12]2)[NH:8]1

Participants

6

Reactant 5

HCID 111,2-DichloroethaneHCID 962WaterHCID 1049PyridineHCID 815143,3-Dimethylbutanoyl chlorideHCID 212015812-oxo-3-tert-butoxycarbonylamino-8-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepine

Product 1

HCID 21201828HCID 21201828, compound

Sources & evidence

ORD record
ord-60e0e458e981492dba4122936ce7a15b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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