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1,2-Dichloroethane → 3-ethylsulfanyl-2-phenyl-N-(1-phenylpropyl)quinoline-4-carboxamide

HRID 177305
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HRID 177305 반응식
[CH2:1]([CH3:2])[S:3][c:4]1[c:5](-[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[n:6][c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]2[c:13]1[C:14](=[O:15])[OH:16].[CH2:41]([Cl:42])[CH2:43][Cl:44].[CH3:34][N:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1.[Cl:55][CH2:56][Cl:57].[OH2:33].[OH:23][n:24]1[c:25]2[c:26]([cH:27][cH:28][cH:29][cH:30]2)[n:31][n:32]1.[c:45]1([CH:51]([CH2:52][CH3:53])[NH2:54])[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[CH2:1]([CH3:2])[S:3][c:4]1[c:5](-[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[n:6][c:7]2[cH:8][cH:9][cH:10][cH:11][c:12]2[c:13]1[C:14](=[O:16])[NH:54][CH:51]([c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1)[CH2:52][CH3:53]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 111,2-DichloroethaneHCID 962WaterHCID 6344DichloromethaneHCID 79724-MethylmorpholineHCID 180541-Phenylpropan-1-amineHCID 757711-HydroxybenzotriazoleHCID 6245133-(Ethylthio)-2-phenylquinoline-4-carboxylic acid

생성물 1

HCID 722557623-ethylsulfanyl-2-phenyl-N-(1-phenylpropyl)quinoline-4-carboxamide

출처 및 근거

ORD 기록
ord-4bdddd2c7b6e4ef49c1c140f16a4c693
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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