Trifluoroacetic acid → HCID 178491678, compound

HRID 2155406Notes

Reaction equation

HRID 2155406 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][S:8][CH:9]2[CH2:10][CH:11]([C:27](=[O:28])[OH:29])[N:12]([C:14](=[O:15])[O:16][CH2:17][c:18]3[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][cH:23]3)[CH2:13]2)[cH:30][cH:31]1.[CH3:46][N:47]([C:48]1=[N:53][CH2:52][CH2:51][NH:50][CH2:49]1)[CH3:54].[CH:55]([N:56]([CH:57]([CH3:58])[CH3:59])[CH2:60][CH3:61])([CH3:62])[CH3:63].[F:32][C:33]([F:34])([F:35])[C:36]([OH:37])=[O:38].[F:39][C:40]([F:41])([F:42])[C:43]([OH:44])=[O:45]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][S:8][CH:9]2[CH2:10][CH:11]([C:27](=[O:28])[N:50]3[CH2:49][C:48]([N:47]([CH3:46])[CH3:54])=[N:53][CH2:52][CH2:51]3)[N:12]([C:14](=[O:15])[O:16][CH2:17][c:18]3[cH:19][cH:20][c:21]([N+:24](=[O:25])[O-:26])[cH:22][cH:23]3)[CH2:13]2)[cH:30][cH:31]1

Participants

5

Reactant 4

HCID 6422Trifluoroacetic acid2×HCID 81531DiisopropylethylamineHCID 186998144-[(4-Methoxyphenyl)methylsulfanyl]-1-[(4-nitrophenyl)methoxycarbonyl]pyrrolidine-2-carboxylic acidHCID 54371944HCID 54371944, compound

Product 1

HCID 178491678HCID 178491678, compound

Sources & evidence

ORD record
ord-bb417bc0e6b04d72bdf5aeb36d5830bc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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