Dimethylformamide → 6-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-N-morpholin-4-yl-nicotinamide

HRID 137866

Reaction equation

HRID 137866 reaction equation
[B-:31]([F:32])([F:33])([F:34])[F:35].[CH3:1][c:2]1[c:3]([CH2:13][O:14][c:15]2[n:16][cH:17][c:18]([C:19](=[O:20])[OH:21])[cH:22][cH:23]2)[c:4](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[n:5][o:6]1.[CH:53]([N:54]([CH2:55][CH3:56])[CH:57]([CH3:58])[CH3:59])([CH3:60])[CH3:61].[NH2:24][N:25]1[CH2:26][CH2:27][O:28][CH2:29][CH2:30]1.[O:62]=[CH:63][N:64]([CH3:65])[CH3:66].[n:36]1([O:37][C:38]([N:39]([CH3:40])[CH3:41])=[N+:42]([CH3:43])[CH3:44])[c:45]2[cH:46][cH:47][cH:48][cH:49][c:50]2[n:51][n:52]1>>[CH3:1][c:2]1[c:3]([CH2:13][O:14][c:15]2[n:16][cH:17][c:18]([C:19](=[O:21])[NH:24][N:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[cH:22][cH:23]2)[c:4](-[c:7]2[cH:8][cH:9][cH:10][cH:11][cH:12]2)[n:5][o:6]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 20315N-AminomorpholineHCID 26255TetrafluoroborateHCID 81531DiisopropylethylamineHCID 130500O-benzotriazol-1-yl-tetramethyluroniumHCID 665992136-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-nicotinic acid

Product 1

HCID 498009756-(5-Methyl-3-phenyl-isoxazol-4-ylmethoxy)-N-morpholin-4-yl-nicotinamide

Sources & evidence

ORD record
ord-cf71e30a483c44758dd1388bfa46809d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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