Water → HCID 66614322, compound

HRID 680071Notes

Reaction equation

HRID 680071 reaction equation
[CH3:26][c:27]1[cH:28][c:29]([NH2:32])[n:30][nH:31]1.[CH:33]([N:34]([CH2:35][CH3:36])[CH:37]([CH3:38])[CH3:39])([CH3:40])[CH3:41].[Cl:1][c:2]1[n:3][c:4]([C:16]([c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)([F:24])[F:25])[n:5][c:6]2[cH:7][c:8]([C:12](=[O:13])[O:14][CH3:15])[cH:9][cH:10][c:11]12.[O:42]=[CH:43][N:44]([CH3:45])[CH3:46].[OH2:47]>>[c:2]1([NH:32][c:29]2[cH:28][c:27]([CH3:26])[nH:31][n:30]2)[n:3][c:4]([C:16]([c:17]2[cH:18][cH:19][c:20]([F:23])[cH:21][cH:22]2)([F:24])[F:25])[n:5][c:6]2[cH:7][c:8]([C:12](=[O:13])[O:14][CH3:15])[cH:9][cH:10][c:11]12

Participants

6

Reactant 5

HCID 962WaterHCID 6228DimethylformamideHCID 81531DiisopropylethylamineHCID 931461H-Pyrazol-3-amine, 5-methyl-HCID 86649061HCID 86649061, compound

Product 1

HCID 66614322HCID 66614322, compound

Sources & evidence

ORD record
ord-789d9cc1194e42429b6afc3958d353d5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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