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Sodium Ion → N-{3-[5-(2-amino-4-pyrimidinyl)-2-(1,1-dimethylethyl)-1,3-thiazol-4-yl]-2-fluorophenyl}-2-pyridinesulfonamide

HRID 1139357
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HRID 1139357 반응식
[Cl:11][N:12]1[C:13](=[O:14])[CH2:15][CH2:16][C:17]1=[O:18].[Cl:54][CH2:55][Cl:56].[NH2:24][c:25]1[c:26]([F:47])[c:27](-[c:31]2[n:32][c:33]([C:43]([CH3:44])([CH3:45])[CH3:46])[s:34][c:35]2-[c:36]2[n:37][c:38]([NH2:42])[n:39][cH:40][cH:41]2)[cH:28][cH:29][cH:30]1.[Na+:10].[S:19]([Cl:20])([Cl:21])(=[O:22])=[O:23].[cH:48]1[cH:49][cH:50][n:51][cH:52][cH:53]1.[n:1]1[c:2]([S:7](=[O:8])[O-:9])[cH:3][cH:4][cH:5][cH:6]1>>[n:1]1[c:2]([S:7](=[O:8])(=[O:9])[NH:24][c:25]2[c:26]([F:47])[c:27](-[c:31]3[n:32][c:33]([C:43]([CH3:44])([CH3:45])[CH3:46])[s:34][c:35]3-[c:36]3[n:37][c:38]([NH2:42])[n:39][cH:40][cH:41]3)[cH:28][cH:29][cH:30]2)[cH:3][cH:4][cH:5][cH:6]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 923Sodium IonHCID 1049PyridineHCID 6344DichloromethaneHCID 24648Sulfuryl chlorideHCID 31398ChlorosuccinimideHCID 18356920CID 18356920HCID 579897094-[4-(3-Amino-2-fluorophenyl)-2-(1,1-dimethylethyl)-1,3-thiazol-5-yl]-2-pyrimidinamine

생성물

1
HCID 57989786N-{3-[5-(2-amino-4-pyrimidinyl)-2-(1,1-dimethylethyl)-1,3-thiazol-4-yl]-2-fluorophenyl}-2-pyridinesulfonamide

출처 및 근거

ORD 기록
ord-b0dac6e3d05340e2bcd6f5bb8fefc6a2
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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