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Methanol → 4-bromo-N-{4-[(4-dimethylamino-quinazolin-2-ylamino)-methyl]-phenyl}-2-trifluoromethoxy-benzenesulfonamide

HRID 203133
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HRID 203133 반응식
[Br:33][c:34]1[cH:35][c:36]([O:44][C:45]([F:46])([F:47])[F:48])[c:37]([S:40](=[O:41])(=[O:42])[Cl:43])[cH:38][cH:39]1.[CH2:1]([O:2][C:3](=[O:4])[NH:10][c:11]1[cH:12][cH:13][c:14]([CH2:17][NH:18][c:19]2[n:20][c:21]3[cH:22][cH:23][cH:24][cH:25][c:26]3[c:27]([N:29]([CH3:30])[CH3:31])[n:28]2)[cH:15][cH:16]1)[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:32]1.[CH3:49][OH:50].[Cl:51][CH2:52][Cl:53]>>[NH:10]([c:11]1[cH:12][cH:13][c:14]([CH2:17][NH:18][c:19]2[n:20][c:21]3[cH:22][cH:23][cH:24][cH:25][c:26]3[c:27]([N:29]([CH3:30])[CH3:31])[n:28]2)[cH:15][cH:16]1)[S:40]([c:37]1[c:36]([O:44][C:45]([F:46])([F:47])[F:48])[cH:35][c:34]([Br:33])[cH:39][cH:38]1)(=[O:41])=[O:42]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 887MethanolHCID 6344DichloromethaneHCID 27364214-Bromo-2-(Trifluoromethoxy)Benzene-1-Sulfonyl ChlorideHCID 68847095{4-[(4-Dimethylamino-quinazolin-2-ylamino)-methyl]-phenyl}-carbamic acid benzyl ester

생성물 1

HCID 577144114-bromo-N-{4-[(4-dimethylamino-quinazolin-2-ylamino)-methyl]-phenyl}-2-trifluoromethoxy-benzenesulfonamide

출처 및 근거

ORD 기록
ord-2d97097f1cf74a389be8e76d835d14c7
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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