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Potassium Cation → 5-[6-(Dimethylamino)-3-pyridinyl]-3-(1,1-dioxidotetrahydro-2H-thiopyran-4-yl)-1H-indole-7-carboxamide

HRID 290052
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반응식

HRID 290052 반응식
[Br:13][c:14]1[cH:15][c:16]2[c:17]([CH:26]3[CH2:27][CH2:28][S:29](=[O:32])(=[O:33])[CH2:30][CH2:31]3)[cH:18][nH:19][c:20]2[c:21]([C:23](=[O:24])[NH2:25])[cH:22]1.[C:34](=[O:35])([O-:36])[O-:37].[CH3:1][N:2]([c:3]1[cH:4][cH:5][c:6]([B:9]([OH:10])[OH:11])[cH:7][n:8]1)[CH3:12].[K+:38].[K+:39].[O:41]1[CH2:42][CH2:43][O:44][CH2:45][CH2:46]1.[OH2:40]>>[CH3:1][N:2]([c:3]1[cH:4][cH:5][c:6](-[c:14]2[cH:15][c:16]3[c:17]([CH:26]4[CH2:27][CH2:28][S:29](=[O:32])(=[O:33])[CH2:30][CH2:31]4)[cH:18][nH:19][c:20]3[c:21]([C:23](=[O:24])[NH2:25])[cH:22]2)[cH:7][n:8]1)[CH3:12]
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참가 물질

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반응물 6

HCID 813Potassium Cation2회HCID 962WaterHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 27632716-(Dimethylamino)pyridine-3-boronic acidHCID 593327575-Bromo-3-(1,1-dioxidotetrahydro-2H-thiopyran-4-yl)-1H-indole-7-carboxamide

생성물 1

HCID 59332701
5-[6-(Dimethylamino)-3-pyridinyl]-3-(1,1-dioxidotetrahydro-2H-thiopyran-4-yl)-1H-indole-7-carboxamide

출처 및 근거

ORD 기록
ord-047bbc0572934a52995d7c6737eda513
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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