Diethyl Ether → 2-Chloro-N-[1-(cyanomethyl)-2-oxo-1,2,3,4-tetrahydroquinolin-3-yl]-6H-thieno[2,3-b]pyrrole-5-carboxamide

HRID 142754Notes

Reaction equation

HRID 142754 reaction equation
[CH3:1][CH2:2][N:3]=[C:4]=[N:5][CH2:6][CH2:7][CH2:8][N:9]([CH3:10])[CH3:11].[CH3:55][CH2:56][O:57][CH2:58][CH3:59].[Cl:12][c:13]1[cH:14][c:15]2[c:16]([nH:17][c:18]([C:20](=[O:21])[NH:22][CH:23]3[C:24](=[O:38])[N:25]([CH2:33][CH:34]([OH:35])[CH2:36][OH:37])[c:26]4[cH:27][cH:28][cH:29][cH:30][c:31]4[CH2:32]3)[cH:19]2)[s:39]1.[Cl:60][CH2:61][Cl:62].[NH2:40][CH:41]1[CH2:42][c:43]2[c:44]([cH:45][cH:46][cH:47][cH:48]2)[N:49]([CH2:50][C:51]#[N:52])[C:53]1=[O:54]>>[N:3]#[C:34][CH2:33][N:25]1[C:24](=[O:38])[CH:23]([NH:22][C:20]([c:18]2[nH:17][c:16]3[c:15]([cH:14][c:13]([Cl:12])[s:39]3)[cH:19]2)=[O:21])[CH2:32][c:31]2[c:26]1[cH:27][cH:28][cH:29][cH:30]2

Participants

6

Reactant 5

HCID 3283Diethyl EtherHCID 6344DichloromethaneHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 117428502-chloro-N-(1-(2,3-dihydroxypropyl)-2-oxo-1,2,3,4-tetrahydroquinolin-3-yl)-6H-thieno(2,3-b)pyrrole-5-carboxamideHCID 21906832(3-amino-2-oxo-3,4-dihydroquinolin-1(2H)-yl)acetonitrile

Product 1

HCID 104526402-Chloro-N-[1-(cyanomethyl)-2-oxo-1,2,3,4-tetrahydroquinolin-3-yl]-6H-thieno[2,3-b]pyrrole-5-carboxamide

Sources & evidence

ORD record
ord-edac9640874a42c58d9244cf4ff99bab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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