Cyclohexylamine → [2-(4-Chloro-phenyl)-2H-indazol-3-yl]cyclohexyl-amine

HRID 168367Notes

Reaction equation

HRID 168367 reaction equation
[CH2:1]([N:5]([C:2]([NH:3][CH:4]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].[CH3:38][N:39]1[CH2:40][CH2:41][CH2:42][C:43]1=[O:44].[NH2:31][CH:32]1[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37]1>>[NH:5]([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)[CH:32]1[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37]1

Participants

4

Reactant 3

HCID 7965CyclohexylamineHCID 13387N-methyl-2-pyrrolidoneHCID 451106161-Butyl-1-[2-(4-chloro-phenyl)-2H-indazol-3-yl]-3-cyclohexyl-urea

Product 1

HCID 66905444[2-(4-Chloro-phenyl)-2H-indazol-3-yl]cyclohexyl-amine

Sources & evidence

ORD record
ord-6ed3833cefb840abb1f21fa8c1ee839e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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