Ammonium → N-{3-[5-(2-Amino-4-pyrimidinyl)-2-(dimethylamino)-1,3-thiazol-4-yl]phenyl}-2,6-difluorobenzenesulfonamide

반응식

[Cl:1][c:2]1[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:16]3[cH:17][c:18]([NH:22][S:23](=[O:24])(=[O:25])[c:26]4[c:27]([F:33])[cH:28][cH:29][cH:30][c:31]4[F:32])[cH:19][cH:20][cH:21]3)[n:10][c:11]([N:13]([CH3:14])[CH3:15])[s:12]2)[n:7]1.[NH4+:35].[OH-:34]>>[c:2]1([NH2:35])[n:3][cH:4][cH:5][c:6](-[c:8]2[c:9](-[c:16]3[cH:17][c:18]([NH:22][S:23](=[O:24])(=[O:25])[c:26]4[c:27]([F:33])[cH:28][cH:29][cH:30][c:31]4[F:32])[cH:19][cH:20][cH:21]3)[n:10][c:11]([N:13]([CH3:14])[CH3:15])[s:12]2)[n:7]1

참가 물질

반응물 3

HCID 223Ammonium

HCID 961Hydroxide

HCID 57989858N-{3-[5-(2-Chloro-4-pyrimidinyl)-2-(dimethylamino)-1,3-thiazol-4-yl]phenyl}-2,6-difluorobenzenesulfonamide

생성물 1

HCID 57989984N-{3-[5-(2-Amino-4-pyrimidinyl)-2-(dimethylamino)-1,3-thiazol-4-yl]phenyl}-2,6-difluorobenzenesulfonamide

출처 및 근거

ORD 기록: ord-119d0c6e282447e4879c7c8ff8ec5a20
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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