Dimethylformamide → 2-Chloromethyl-N-[7-(4-fluoro-phenyl)-4-methoxy-benzooxazol-2-yl]-isonicotinamide

HRID 189537Notes

Reaction equation

HRID 189537 reaction equation
[CH2:55]1[O:56][CH2:57][CH2:58][CH2:59]1.[Cl:1][CH2:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10][n:11]1.[F:36][c:37]1[cH:38][cH:39][c:40](-[c:43]2[cH:44][cH:45][c:46]([O:53][CH3:54])[c:47]3[n:48][c:49]([NH2:52])[o:50][c:51]23)[cH:41][cH:42]1.[O:60]1[CH2:61][CH2:62][O:63][CH2:64][CH2:65]1.[O:66]=[CH:67][N:68]([CH3:69])[CH3:70].[P-:12]([F:13])([F:14])([F:15])([F:16])([F:17])[F:18].[n:19]1([O:20][C:21]([N:22]([CH3:23])[CH3:24])=[N+:25]([CH3:26])[CH3:27])[c:28]2[n:29][cH:30][cH:31][cH:32][c:33]2[n:34][n:35]1>>[Cl:1][CH2:2][c:3]1[cH:4][c:5]([C:6](=[O:8])[NH:52][c:49]2[n:48][c:47]3[c:46]([O:53][CH3:54])[cH:45][cH:44][c:43](-[c:40]4[cH:39][cH:38][c:37]([F:36])[cH:42][cH:41]4)[c:51]3[o:50]2)[cH:9][cH:10][n:11]1

Participants

8

Reactant 7

HCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 9886HexafluorophosphateHCID 312751,4-DioxaneHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 222522347-(4-Fluoro-phenyl)-4-methoxy-benzooxazol-2-ylamineHCID 222522422-(Chloromethyl)isonicotinic acid

Product 1

HCID 100930682-Chloromethyl-N-[7-(4-fluoro-phenyl)-4-methoxy-benzooxazol-2-yl]-isonicotinamide

Sources & evidence

ORD record
ord-407c16bc96a04cd1b4c3a5d46d83d98c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…