3-Chloro-4-fluoroaniline → HCID 66905355, compound

HRID 2151931Notes

Reaction equation

HRID 2151931 reaction equation
[CH2:1]([N:2]([C:3]([NH:4][CH:5]1[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1)=[O:11])[c:15]1[n:16](-[c:24]2[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]2)[n:17][c:18]2[cH:19][cH:20][cH:21][cH:22][c:23]12)[CH2:12][CH2:13][CH3:14].[CH3:40][N:41]1[CH2:42][CH2:43][CH2:44][C:45]1=[O:46].[Cl:31][c:32]1[cH:33][c:34]([NH2:39])[cH:35][cH:36][c:37]1[F:38]>>[c:15]1([NH:39][c:34]2[cH:33][c:32]([Cl:31])[c:37]([F:38])[cH:36][cH:35]2)[n:16](-[c:24]2[cH:25][cH:26][c:27]([Cl:30])[cH:28][cH:29]2)[n:17][c:18]2[cH:19][cH:20][cH:21][cH:22][c:23]12

Participants

4

Reactant 3

HCID 97083-Chloro-4-fluoroanilineHCID 13387N-methyl-2-pyrrolidoneHCID 451106161-Butyl-1-[2-(4-chloro-phenyl)-2H-indazol-3-yl]-3-cyclohexyl-urea

Product 1

HCID 66905355HCID 66905355, compound

Sources & evidence

ORD record
ord-889cc628960b4d55b08654576e70ebc9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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