Trifluoroacetic acid → HCID 76567959, compound

HRID 201175Notes

Reaction equation

HRID 201175 reaction equation
[CH3:40][S:41](=[O:42])(=[O:43])[N:44]1[CH2:45][CH2:46][CH:47]([NH2:50])[CH2:48][CH2:49]1.[CH3:51][N:52]1[CH2:53][CH2:54][O:55][CH2:56][CH2:57]1.[CH3:58][N:59]([CH3:60])[c:61]1[cH:62][cH:63][n:64][cH:65][cH:66]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:9]([cH:10]1)[NH:8][C:7](=[O:11])[C:6]21[CH:12]([C:29]([CH2:30][CH3:31])=[CH2:32])[N:13]([CH2:25][C:26](=[O:27])[F:28])[C:14](=[O:24])[CH2:15][CH:16]1[c:17]1[cH:18][c:19]([Cl:23])[cH:20][cH:21][cH:22]1.[F:33][C:34]([F:35])([F:36])[C:37]([OH:38])=[O:39].[O:67]1[CH2:68][CH2:69][CH2:70][CH2:71]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:9]([cH:10]1)[NH:8][C:7](=[O:11])[C:6]21[CH:12]([C:29]([CH2:30][CH3:31])=[CH2:32])[N:13]([CH2:25][C:26](=[O:27])[NH:50][CH:47]2[CH2:46][CH2:45][N:44]([S:41]([CH3:40])(=[O:42])=[O:43])[CH2:49][CH2:48]2)[C:14](=[O:24])[CH2:15][CH:16]1[c:17]1[cH:18][c:19]([Cl:23])[cH:20][cH:21][cH:22]1

Participants

7

Reactant 6

HCID 6422Trifluoroacetic acidHCID 79724-MethylmorpholineHCID 8028TetrahydrofuranHCID 142844-(Dimethylamino)pyridineHCID 113558261-(Methanesulfonyl)piperidin-4-amineHCID 76568053HCID 76568053, compound

Product 1

HCID 76567959HCID 76567959, compound

Sources & evidence

ORD record
ord-dd3f65239c134023b16bd5f340e54b35
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…