Trifluoroacetic acid → N-(2-amino-4-fluorophenyl)-4-[N-cinnamoylaminomethyl]benzamide

HRID 2331031Notes

Reaction equation

HRID 2331031 reaction equation
[C:1]([CH:2]=[CH:3][c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)(=[O:10])[NH:11][CH2:12][c:13]1[cH:14][cH:15][c:16]([C:17](=[O:18])[OH:19])[cH:20][cH:21]1.[F:22][c:23]1[cH:24][c:25]([NH2:30])[c:26]([NH2:29])[cH:27][cH:28]1.[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1.[OH:31][C:32]([C:33]([F:34])([F:35])[F:36])=[O:37]>>[C:1]([CH:2]=[CH:3][c:4]1[cH:5][cH:6][cH:7][cH:8][cH:9]1)(=[O:10])[NH:11][CH2:12][c:13]1[cH:14][cH:15][c:16]([C:17](=[O:19])[NH:29][c:26]2[c:25]([NH2:30])[cH:24][c:23]([F:22])[cH:28][cH:27]2)[cH:20][cH:21]1

Participants

5

Reactant 4

HCID 6422Trifluoroacetic acidHCID 8028TetrahydrofuranHCID 1645844-Fluorobenzene-1,2-diamineHCID 54481087N-(4-Carboxybenzyl)cinnamamide

Product 1

HCID 69057886N-(2-amino-4-fluorophenyl)-4-[N-cinnamoylaminomethyl]benzamide

Sources & evidence

ORD record
ord-fa9f22acfc8b4781b1d1f3ebf347ecf7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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