Dimethylformamide → [2-(3-Hexyl-phenyl)-5-iodo-3-methyl-3H-imidazol-4-yl]-(4-pyrrolidin-1-yl-piperidin-1-yl)-methanone

HRID 143702

Reaction equation

HRID 143702 reaction equation
[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH3:6])[c:7]1[cH:8][c:9](-[c:13]2[n:14][c:15]([I:22])[c:16]([C:19](=[O:20])[OH:21])[n:17]2[CH3:18])[cH:10][cH:11][cH:12]1.[CH3:47][CH2:48][N:49]([CH2:50][CH3:51])[CH2:52][CH3:53].[N:54]1([CH:59]2[CH2:60][CH2:61][NH:62][CH2:63][CH2:64]2)[CH2:55][CH2:56][CH2:57][CH2:58]1.[O:65]=[CH:66][N:67]([CH3:68])[CH3:69].[P-:23]([F:24])([F:25])([F:26])([F:27])([F:28])[F:29].[n:30]1([O:31][C:32]([N:33]([CH3:34])[CH3:35])=[N+:36]([CH3:37])[CH3:38])[c:39]2[n:40][cH:41][cH:42][cH:43][c:44]2[n:45][n:46]1>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH3:6])[c:7]1[cH:8][c:9](-[c:13]2[n:14][c:15]([I:22])[c:16]([C:19](=[O:21])[N:62]3[CH2:61][CH2:60][CH:59]([N:54]4[CH2:55][CH2:56][CH2:57][CH2:58]4)[CH2:64][CH2:63]3)[n:17]2[CH3:18])[cH:10][cH:11][cH:12]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 8471TriethylamineHCID 9886HexafluorophosphateHCID 787034-(1-Pyrrolidinyl)piperidineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 671332392-(3-Hexyl-phenyl)-5-iodo-3-methyl-3H-imidazole-4-carboxylic acid

Product 1

HCID 57541122[2-(3-Hexyl-phenyl)-5-iodo-3-methyl-3H-imidazol-4-yl]-(4-pyrrolidin-1-yl-piperidin-1-yl)-methanone

Sources & evidence

ORD record
ord-8ce31de594474f1cb1b37058f821974e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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