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Water → N-{2-[4-amino-2-(ethoxymethyl)-7-(prop-2-ynyloxy)-1H-imidazo[4,5-c]quinolin-1-yl]-1,1-dimethylethyl}methanesulfonamide

HRID 317365
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반응식

HRID 317365 반응식
[C:33](=[O:34])([O-:35])[O-:36].[CH2:1]([C:2]#[CH:3])[Br:4].[Cl:45][CH2:46][Cl:47].[Cs+:37].[Cs+:38].[NH2:5][c:6]1[n:7][c:8]2[cH:9][c:10]([OH:32])[cH:11][cH:12][c:13]2[c:14]2[c:15]1[n:16][c:17]([CH2:28][O:29][CH2:30][CH3:31])[n:18]2[CH2:19][C:20]([CH3:21])([CH3:22])[NH:23][S:24](=[O:25])(=[O:26])[CH3:27].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44].[OH2:39]>>[CH:1]#[C:2][CH2:3][O:32][c:10]1[cH:9][c:8]2[n:7][c:6]([NH2:5])[c:15]3[c:14]([c:13]2[cH:12][cH:11]1)[n:18]([CH2:19][C:20]([CH3:21])([CH3:22])[NH:23][S:24](=[O:25])(=[O:26])[CH3:27])[c:17]([CH2:28][O:29][CH2:30][CH3:31])[n:16]3
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참가 물질

8

반응물 7

HCID 962WaterHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 7842Propargyl bromideHCID 19660Carbonate IonHCID 104967Cesium cation2회HCID 136075196N-[2-(4-amino-2-ethoxymethyl-7-hydroxy-1H-imidazo[4,5-c]quinolin-1-yl)-1,1-dimethylethyl]methanesulfonamide

생성물 1

HCID 86626178N-{2-[4-amino-2-(ethoxymethyl)-7-(prop-2-ynyloxy)-1H-imidazo[4,5-c]quinolin-1-yl]-1,1-dimethylethyl}methanesulfonamide

출처 및 근거

ORD 기록
ord-8225579e444447c8bfa1010a0f25c040
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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