Dimethylformamide → 8-[3-(5,6-dichloro-1,3-dihydro-2-oxo-2H-benzimidazol-1-yl)propyl]-1-phenyl-1,3,8-triazaspiro[4,5]decan-4-one

HRID 1551429Notes

Reaction equation

HRID 1551429 reaction equation
[CH3:1][S:2]([OH:3])(=[O:4])=[O:5].[CH3:39][N:40]([CH3:41])[CH:42]=[O:43].[Cl:6][c:7]1[cH:8][c:9]2[c:10]([n:11]([CH2:15][CH2:16][CH2:17][OH:18])[c:12](=[O:14])[nH:13]2)[cH:19][c:20]1[Cl:21].[c:22]1([N:28]2[CH2:29][NH:30][C:31](=[O:38])[C:32]23[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]3)[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[Cl:6][c:7]1[cH:8][c:9]2[c:10]([n:11]([CH2:15][CH2:16][CH2:17][N:35]3[CH2:34][CH2:33][C:32]4([N:28]([c:22]5[cH:23][cH:24][cH:25][cH:26][cH:27]5)[CH2:29][NH:30][C:31]4=[O:38])[CH2:37][CH2:36]3)[c:12](=[O:14])[nH:13]2)[cH:19][c:20]1[Cl:21]

Participants

5

Reactant 4

HCID 6228DimethylformamideHCID 6395Methanesulfonic AcidHCID 705561-Phenyl-1,3,8-triazaspiro(4.5)decan-4-oneHCID 202880345,6-dichloro-1,3-dihydro-1-(3-hydroxypropyl)-2H-benzimidazol-2-one

Product 1

HCID 203856358-[3-(5,6-dichloro-1,3-dihydro-2-oxo-2H-benzimidazol-1-yl)propyl]-1-phenyl-1,3,8-triazaspiro[4,5]decan-4-one

Sources & evidence

ORD record
ord-76af9d5ee8d04697b242a974495a9a91
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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