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Bicarbonate Ion → N-{4-[(6,7-Dimethoxy-4-quinolyl)oxy]phenyl}-N'-(3-dimethylaminophenyl)urea

HRID 205079
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HRID 205079 반응식
[C:45](=[O:46])([O-:47])[OH:48].[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][cH:18][c:19]([NH2:22])[cH:20][cH:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14].[CH3:35][N:36]([c:37]1[cH:38][c:39]([NH2:40])[cH:41][cH:42][cH:43]1)[CH3:44].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[CH3:57][CH2:58][N:59]([CH2:60][CH3:61])[CH2:62][CH3:63].[Cl:23][C:24]([Cl:25])([O:26][C:27]([O:28][C:29]([Cl:30])([Cl:31])[Cl:32])=[O:33])[Cl:34].[Na+:49]>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([O:15][c:16]3[cH:17][cH:18][c:19]([NH:22][C:27](=[O:33])[NH:40][c:39]4[cH:38][c:37]([N:36]([CH3:35])[CH3:44])[cH:43][cH:42][cH:41]4)[cH:20][cH:21]3)[cH:7][cH:8][n:9][c:10]2[cH:11][c:12]1[O:13][CH3:14]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 1140TolueneHCID 8471TriethylamineHCID 76084N,N-dimethyl-m-phenylenediamineHCID 94429TriphosgeneHCID 115945434-[(6,7-Dimethoxyquinolin-4-yl)oxy]aniline

생성물 1

HCID 22132661
N-{4-[(6,7-Dimethoxy-4-quinolyl)oxy]phenyl}-N'-(3-dimethylaminophenyl)urea

출처 및 근거

ORD 기록
ord-7ef0dd7f9429451d80ad678d684de6e2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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