Trifluoroacetic acid → HCID 178437314, compound

HRID 94229Notes

Reaction equation

HRID 94229 reaction equation
[Cl:22][c:23]1[cH:24][cH:25][c:26]([CH:28]=[CH:29][C:30](=[O:31])[OH:32])[s:27]1.[F:33][C:34]([F:35])([F:36])[C:37]([OH:38])=[O:39].[NH2:1][c:2]1[n:3][cH:4][n:5][c:6]2[cH:7][c:8]([CH2:12][N:13]3[C:14](=[O:21])[CH:15]([CH2:19][CH3:20])[NH:16][CH2:17][CH2:18]3)[cH:9][cH:10][c:11]12>>[NH2:1][c:2]1[n:3][cH:4][n:5][c:6]2[cH:7][c:8]([CH2:12][N:13]3[C:14](=[O:21])[CH:15]([CH2:19][CH3:20])[N:16]([C:30]([CH:29]=[CH:28][c:26]4[cH:25][cH:24][c:23]([Cl:22])[s:27]4)=[O:31])[CH2:17][CH2:18]3)[cH:9][cH:10][c:11]12

Participants

4

Reactant 3

HCID 6422Trifluoroacetic acidHCID 179851971-(4-Aminoquinazoline-7-ylmethyl)-3-ethylpiperazine-2-oneHCID 534018273-(5-Chlorothiophen-2-yl)prop-2-enoic acid

Product 1

HCID 178437314HCID 178437314, compound

Sources & evidence

ORD record
ord-a6009703c2c049e9bcd3c2660d825d8e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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