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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Potassium Cation → 6-acetyl-3-(2-(4-(6-fluoro-1-methyl-1H-indazol-3-yl)piperidin-1-yl) ethyl)-4,5,6,7-tetrahydro-2-methylthieno[2,3-c]pyridine

HRID 1231348
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HRID 1231348 반응식
[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][c:6]2[c:7]([c:10]([CH2:14][CH2:15][Br:16])[c:11]([CH3:13])[s:12]2)[CH2:8][CH2:9]1.[C:34](=[O:35])([O-:36])[O-:37].[CH3:42][N:43]([CH3:44])[CH:45]=[O:46].[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[F:17][c:18]1[cH:19][cH:20][c:21]2[c:22]([CH:28]3[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]3)[n:23][n:24]([CH3:27])[c:25]2[cH:26]1.[I-:41].[K+:38].[K+:39].[K+:40]>>[C:1]([CH3:2])(=[O:3])[N:4]1[CH2:5][c:6]2[c:7]([c:10]([CH2:14][CH2:15][N:31]3[CH2:30][CH2:29][CH:28]([c:22]4[c:21]5[cH:20][cH:19][c:18]([F:17])[cH:26][c:25]5[n:24]([CH3:27])[n:23]4)[CH2:33][CH2:32]3)[c:11]([CH3:13])[s:12]2)[CH2:8][CH2:9]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 813Potassium Cation3회HCID 1140TolueneHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 30165Iodide IonHCID 140326086-Fluoro-1-methyl-3-(piperidin-4-yl)-1H-indazoleHCID 214719356-Acety-3-(2-bromoethyl)-4,5,6,7-tetrahydro-2-methylthieno[2,3-c]pyridine

생성물 1

HCID 194388186-acetyl-3-(2-(4-(6-fluoro-1-methyl-1H-indazol-3-yl)piperidin-1-yl) ethyl)-4,5,6,7-tetrahydro-2-methylthieno[2,3-c]pyridine

출처 및 근거

ORD 기록
ord-0dcb5c11e0e44003b36240f5fa1b9b79
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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