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Bicarbonate Ion → 4-(4-fluorobenzoyl)-1-[3-(2-methylthio-10H-phenothiazin-10-yl)propyl]piperidine

HRID 2347160
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HRID 2347160 반응식
[C:1](=[O:2])([OH:3])[O-:4].[CH3:41][N:42]([CH3:43])[CH:44]=[O:45].[Cl:21][CH2:22][CH2:23][CH2:24][N:25]1[c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]2[S:32][c:33]2[cH:34][cH:35][c:36]([S:39][CH3:40])[cH:37][c:38]21.[F:6][c:7]1[cH:8][cH:9][c:10]([C:11](=[O:12])[CH:13]2[CH2:14][CH2:15][NH:16][CH2:17][CH2:18]2)[cH:19][cH:20]1.[Na+:5]>>[F:6][c:7]1[cH:8][cH:9][c:10]([C:11](=[O:12])[CH:13]2[CH2:14][CH2:15][N:16]([CH2:22][CH2:23][CH2:24][N:25]3[c:26]4[cH:27][cH:28][cH:29][cH:30][c:31]4[S:32][c:33]4[cH:34][cH:35][c:36]([S:39][CH3:40])[cH:37][c:38]43)[CH2:17][CH2:18]2)[cH:19][cH:20]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 769Bicarbonate IonHCID 923Sodium IonHCID 6228DimethylformamideHCID 27244404-(4-Fluorobenzoyl)piperidineHCID 143914902-Methylthio-10-(3-chloropropyl)-phenothiazine

생성물 1

HCID 143914914-(4-fluorobenzoyl)-1-[3-(2-methylthio-10H-phenothiazin-10-yl)propyl]piperidine

출처 및 근거

ORD 기록
ord-5c3926d19d7e4724a312ee65d549e71f
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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