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Potassium Cation → 1-Benzenesulfonylpiperidine-4-carboxylic Acid [4-(3-dimethylaminopyrrolidin-1-yl)-phenyl]amide

HRID 1557764
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HRID 1557764 반응식
[C:24](=[O:25])([O-:26])[O-:27].[CH3:1][N:2]([CH:3]1[CH2:4][N:5]([c:8]2[cH:9][cH:10][c:11]([NH:14][C:15](=[O:16])[CH:17]3[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1)[CH3:23].[CH3:40][N:41]1[CH2:42][CH2:43][CH2:44][C:45]1=[O:46].[K+:28].[K+:29].[c:30]1([S:36](=[O:37])(=[O:38])[Cl:39])[cH:31][cH:32][cH:33][cH:34][cH:35]1>>[CH3:1][N:2]([CH:3]1[CH2:4][N:5]([c:8]2[cH:9][cH:10][c:11]([NH:14][C:15](=[O:16])[CH:17]3[CH2:18][CH2:19][N:20]([S:36]([c:30]4[cH:31][cH:32][cH:33][cH:34][cH:35]4)(=[O:37])=[O:38])[CH2:21][CH2:22]3)[cH:12][cH:13]2)[CH2:6][CH2:7]1)[CH3:23]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 813Potassium Cation2회HCID 7369Benzenesulfonyl chlorideHCID 13387N-methyl-2-pyrrolidoneHCID 19660Carbonate IonHCID 67147939Piperidine-4-carboxylic acid [4-(3-dimethylaminopyrrolidin-1-yl)phenyl]amide

생성물 1

HCID 58867567
1-Benzenesulfonylpiperidine-4-carboxylic Acid [4-(3-dimethylaminopyrrolidin-1-yl)-phenyl]amide

출처 및 근거

ORD 기록
ord-06a0b759839f4ee688b7f0cfb5c470d5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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