Ethyl Acetate → HCID 66988803, compound

HRID 686912Notes

Reaction equation

HRID 686912 reaction equation
[Br:41][c:42]1[cH:43][cH:44][c:45]([S:48](=[O:49])(=[O:50])[c:51]2[cH:52][c:53]3[c:54]([NH:65][c:66]4[cH:67][c:68]([O:72][CH3:73])[cH:69][cH:70][cH:71]4)[c:55]([C:62](=[O:63])[NH2:64])[cH:56][n:57][c:58]3[c:59]([CH3:61])[cH:60]2)[cH:46][cH:47]1.[CH3:74][CH2:75][O:76][C:77](=[O:78])[CH3:79].[OH:1][CH2:2][c:3]1[cH:4][cH:5][c:6](-[c:9]2[cH:10][cH:11][cH:12][c:13]([S:14]([c:15]3[cH:16][c:17]4[c:18]([c:19]([CH3:20])[cH:21]3)[n:22][cH:23][c:24]([C:25]([NH2:26])=[O:27])[c:28]4[NH:29][c:30]3[cH:31][cH:32][cH:33][c:34]([O:35][CH3:36])[cH:37]3)(=[O:38])=[O:39])[cH:40]2)[cH:7][cH:8]1>>[OH:1][CH2:2][c:3]1[cH:4][cH:5][c:6](-[c:42]2[cH:43][cH:44][c:45]([S:48](=[O:49])(=[O:50])[c:51]3[cH:52][c:53]4[c:54]([NH:65][c:66]5[cH:67][c:68]([O:72][CH3:73])[cH:69][cH:70][cH:71]5)[c:55]([C:62](=[O:63])[NH2:64])[cH:56][n:57][c:58]4[c:59]([CH3:61])[cH:60]3)[cH:46][cH:47]2)[cH:7][cH:8]1

Participants

4

Reactant 3

HCID 8857Ethyl AcetateHCID 669882586-((4-Bromophenyl)sulfonyl)-4-((3-methoxyphenyl)amino)-8-methylquinoline-3-carboxamideHCID 66988923HCID 66988923, compound

Product 1

HCID 66988803HCID 66988803, compound

Sources & evidence

ORD record
ord-3b3d6880e5af4bd0868c4084b3b93856
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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