Tetrahydrofuran → 2-({5-Chloro-2-[(1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-7-yl)carbamoyl]phenyl}amino)ethyl methanesulfonate

HRID 1118875Notes

Reaction equation

HRID 1118875 reaction equation
[CH3:36][S:37]([Cl:38])(=[O:39])=[O:40].[CH:27]([N:28]([CH:29]([CH3:30])[CH3:31])[CH2:32][CH3:33])([CH3:34])[CH3:35].[Cl:1][c:2]1[cH:3][c:4]([NH:23][CH2:24][CH2:25][OH:26])[c:5]([C:6](=[O:7])[NH:8][c:9]2[cH:10][cH:11][c:12]3[c:17]([cH:18]2)[N:16]([CH3:19])[C:15](=[O:20])[CH2:14][CH2:13]3)[cH:21][cH:22]1.[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1>>[Cl:1][c:2]1[cH:3][c:4]([NH:23][CH2:24][CH2:25][O:26][S:37]([CH3:36])(=[O:39])=[O:40])[c:5]([C:6](=[O:7])[NH:8][c:9]2[cH:10][cH:11][c:12]3[c:17]([cH:18]2)[N:16]([CH3:19])[C:15](=[O:20])[CH2:14][CH2:13]3)[cH:21][cH:22]1

Participants

5

Reactant 4

HCID 8028TetrahydrofuranHCID 31297Methanesulfonyl chlorideHCID 81531DiisopropylethylamineHCID 578679984-chloro-2-[(2-hydroxyethyl)amino]-N-(1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-7-yl)benzamide

Product 1

HCID 578679622-({5-Chloro-2-[(1-methyl-2-oxo-1,2,3,4-tetrahydroquinolin-7-yl)carbamoyl]phenyl}amino)ethyl methanesulfonate

Sources & evidence

ORD record
ord-0872b89b606f466cad49aee3eee47b0f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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