HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Reaction

Potassium Cation → 2-[(3-[1-[(cyclopropylmethyl)amino]-4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl]-8-nitro-1,1-dioxido-4H-1,2,4-benzothiadiazin-7-yl)oxy]acetamide

HRID 158399
Notes
Print preview

Reaction equation

HRID 158399 reaction equation
[Br:34][CH2:35][C:36](=[O:37])[NH2:38].[C:39](=[O:40])([O-:41])[O-:42].[CH2:51]([N+:52]([CH2:53][CH2:54][CH2:55][CH3:56])([CH2:57][CH2:58][CH2:59][CH3:60])[CH2:61][CH2:62][CH2:63][CH3:64])[CH2:65][CH2:66][CH3:67].[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[CH:1]1([CH2:4][NH:5][n:6]2[c:7](=[O:33])[c:8]([C:17]3=[N:18][S:19](=[O:31])(=[O:32])[c:20]4[c:21]([cH:23][cH:24][c:25]([OH:30])[c:26]4[N+:27](=[O:28])[O-:29])[NH:22]3)[c:9]([OH:16])[c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]23)[CH2:2][CH2:3]1.[I-:50].[K+:43].[K+:44]>>[CH:1]1([CH2:4][NH:5][n:6]2[c:7](=[O:33])[c:8]([C:17]3=[N:18][S:19](=[O:31])(=[O:32])[c:20]4[c:21]([cH:23][cH:24][c:25]([O:30][CH2:35][C:36](=[O:37])[NH2:38])[c:26]4[N+:27](=[O:28])[O-:29])[NH:22]3)[c:9]([OH:16])[c:10]3[cH:11][cH:12][cH:13][cH:14][c:15]23)[CH2:2][CH2:3]1
ParticipantsSources & evidenceReaction notes

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 30165Iodide IonHCID 696322-Bromoacetamide
HCID 136358420
1-[(cyclopropylmethyl)amino]-4-hydroxy-3-(7-hydroxy-8-nitro-1,1-dioxido-4H-1,2,4-benzothiadiazin-3-yl)quinolin-2(1H)-one

Product 1

HCID 1363584212-[(3-[1-[(cyclopropylmethyl)amino]-4-hydroxy-2-oxo-1,2-dihydroquinolin-3-yl]-8-nitro-1,1-dioxido-4H-1,2,4-benzothiadiazin-7-yl)oxy]acetamide

Sources & evidence

ORD record
ord-03e4cecb863a46e8b0ebe8558bb45142
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

Loading…

On this pageParticipantsSources & evidenceReaction notes