Hydrochloric Acid → 4-[4-(1-benzofuran-5-yl)phenyl]-3-[(1-propanoylpyrrolidin-3-yl)methyl]-1H-1,2,4-triazol-5-one

HRID 2128144Notes

Reaction equation

HRID 2128144 reaction equation
[C:38]([CH2:39][CH3:40])(=[O:41])[Cl:42].[CH:29]([N:30]([CH2:31][CH3:32])[CH:33]([CH3:34])[CH3:35])([CH3:36])[CH3:37].[Cl:43][CH2:44][Cl:45].[ClH:1].[o:2]1[cH:3][cH:4][c:5]2[c:6]1[cH:7][cH:8][c:9](-[c:11]1[cH:12][cH:13][c:14](-[n:17]3[c:18](=[O:28])[nH:19][n:20][c:21]3[CH2:22][CH:23]3[CH2:24][NH:25][CH2:26][CH2:27]3)[cH:15][cH:16]1)[cH:10]2>>[o:2]1[cH:3][cH:4][c:5]2[c:6]1[cH:7][cH:8][c:9](-[c:11]1[cH:12][cH:13][c:14](-[n:17]3[c:18](=[O:28])[nH:19][n:20][c:21]3[CH2:22][CH:23]3[CH2:24][N:25]([C:38]([CH2:39][CH3:40])=[O:41])[CH2:26][CH2:27]3)[cH:15][cH:16]1)[cH:10]2

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 62324Propionyl chlorideHCID 81531DiisopropylethylamineHCID 178518805HCID 178518805, compound

Product 1

HCID 673541024-[4-(1-benzofuran-5-yl)phenyl]-3-[(1-propanoylpyrrolidin-3-yl)methyl]-1H-1,2,4-triazol-5-one

Sources & evidence

ORD record
ord-869615774c174bbca406ee136c091f3b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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