Dimethylformamide → 3-[2-(2,4-Dichloro-phenyl)-ethoxy]-4-methyl-N-[1-(5-trichloromethyl-[1,2,4]oxadiazol-3-yl)-piperidin-4-ylmethyl]-benzamide

HRID 109089Notes

Reaction equation

HRID 109089 reaction equation
[CH2:46]([N:47]1[CH2:48][CH2:49][O:50][CH2:51][CH2:52]1)[CH3:53].[Cl:1][c:2]1[c:3]([CH2:9][CH2:10][O:11][c:12]2[cH:13][c:14]([C:15](=[O:16])[OH:17])[cH:18][cH:19][c:20]2[CH3:21])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1.[Cl:54][C:55]([c:56]1[n:57][c:58]([N:61]2[CH2:62][CH2:63][CH:64]([CH2:67][NH2:68])[CH2:65][CH2:66]2)[n:59][o:60]1)([Cl:69])[Cl:70].[F:71][C:72]([F:73])([F:74])[C:75]([OH:76])=[O:77].[O:78]=[CH:79][N:80]([CH3:81])[CH3:82].[P-:22]([F:23])([F:24])([F:25])([F:26])([F:27])[F:28].[n:29]1([O:30][C:31]([N:32]([CH3:33])[CH3:34])=[N+:35]([CH3:36])[CH3:37])[c:38]2[n:39][cH:40][cH:41][cH:42][c:43]2[n:44][n:45]1>>[Cl:1][c:2]1[c:3]([CH2:9][CH2:10][O:11][c:12]2[cH:13][c:14]([C:15](=[O:17])[NH:68][CH2:67][CH:64]3[CH2:63][CH2:62][N:61]([c:58]4[n:57][c:56]([C:55]([Cl:54])([Cl:69])[Cl:70])[o:60][n:59]4)[CH2:66][CH2:65]3)[cH:18][cH:19][c:20]2[CH3:21])[cH:4][cH:5][c:6]([Cl:8])[cH:7]1

Participants

8

Reactant 7

HCID 6228DimethylformamideHCID 6422Trifluoroacetic acidHCID 7525EthylmorpholineHCID 9886HexafluorophosphateHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 220523883-[2-(2,4-Dichloro-phenyl)-ethoxy]-4-methyl-benzoic acidHCID 22052439HCID 22052439, compound

Product 1

HCID 233962313-[2-(2,4-Dichloro-phenyl)-ethoxy]-4-methyl-N-[1-(5-trichloromethyl-[1,2,4]oxadiazol-3-yl)-piperidin-4-ylmethyl]-benzamide

Sources & evidence

ORD record
ord-576e75573a4645f5b63c04f03e214a9e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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