Methanol → 4-[5-tert-butyl-2-[[3-[(4-methoxybenzoyl)amino]-4-pyridinyl]carbamoyl]phenoxy]-N-(2-fluorophenyl)piperidine-1-carboxamide

HRID 200966Notes

Reaction equation

HRID 200966 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:31][CH:32]2[CH2:33][CH2:34][NH:35][CH2:36][CH2:37]2)[c:8]([C:9](=[O:10])[NH:11][c:12]2[c:13]([NH:18][C:19]([c:20]3[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]3)=[O:28])[cH:14][n:15][cH:16][cH:17]2)[cH:29][cH:30]1.[CH3:52][OH:53].[CH:38]([Cl:39])([Cl:40])[Cl:41].[F:42][c:43]1[c:44]([N:49]=[C:50]=[O:51])[cH:45][cH:46][cH:47][cH:48]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:31][CH:32]2[CH2:33][CH2:34][N:35]([C:50]([NH:49][c:44]3[c:43]([F:42])[cH:48][cH:47][cH:46][cH:45]3)=[O:51])[CH2:36][CH2:37]2)[c:8]([C:9](=[O:10])[NH:11][c:12]2[c:13]([NH:18][C:19]([c:20]3[cH:21][cH:22][c:23]([O:26][CH3:27])[cH:24][cH:25]3)=[O:28])[cH:14][n:15][cH:16][cH:17]2)[cH:29][cH:30]1

Participants

5

Reactant 4

HCID 887MethanolHCID 6212ChloroformHCID 855882-Fluorophenyl isocyanateHCID 11576987N4-[4-tert-butyl-2-(piperidin-4-yloxy)benzoyl]-N3-(4-methoxybenzoyl)-3,4-pyridinediamine

Product 1

HCID 116143504-[5-tert-butyl-2-[[3-[(4-methoxybenzoyl)amino]-4-pyridinyl]carbamoyl]phenoxy]-N-(2-fluorophenyl)piperidine-1-carboxamide

Sources & evidence

ORD record
ord-0d2e01d4260e44b6bf87e1dfbb3001a2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…