2-Thiophenecarboxylic acid → N-Propyl-N-(3,3,3-trifluoro-2-hydroxy-2-{[(1-phenyl-1H-indazol-4-yl)amino]methyl}propyl)-2-thiophenecarboxamide

HRID 186468Notes

Reaction equation

HRID 186468 reaction equation
[F:9][C:10]([C:11]([CH2:12][NH:13][c:14]1[c:15]2[cH:16][n:17][n:18](-[c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[c:19]2[cH:20][cH:21][cH:22]1)([OH:29])[CH2:30][NH:31][CH2:32][CH2:33][CH3:34])([F:35])[F:36].[s:1]1[c:2]([C:6](=[O:7])[OH:8])[cH:3][cH:4][cH:5]1>>[s:1]1[c:2]([C:6](=[O:8])[N:31]([CH2:30][C:11]([C:10]([F:9])([F:35])[F:36])([CH2:12][NH:13][c:14]2[c:15]3[cH:16][n:17][n:18](-[c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[c:19]3[cH:20][cH:21][cH:22]2)[OH:29])[CH2:32][CH2:33][CH3:34])[cH:3][cH:4][cH:5]1

Participants

3

Reactant 2

HCID 107002-Thiophenecarboxylic acidHCID 593241711,1,1-Trifluoro-3-[(1-phenyl-1H-indazol-4-yl)amino]-2-[(propylamino)methyl]-2-propanol

Product 1

HCID 59324150N-Propyl-N-(3,3,3-trifluoro-2-hydroxy-2-{[(1-phenyl-1H-indazol-4-yl)amino]methyl}propyl)-2-thiophenecarboxamide

Sources & evidence

ORD record
ord-c435af886e704b5a972e362be250080e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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