7-Chloro-1,2,3,4-tetrahydroisoquinoline → (7-Chloro-3,4-dihydro-1H-isoquinolin-2-yl)-(2-isopropoxy-5-methanesulfonyl-phenyl)-methanone

HRID 170481

반응식

HRID 170481 반응식
[CH:12]([CH3:13])([CH3:14])[O:15][c:16]1[c:17]([C:18](=[O:19])[OH:20])[cH:21][c:22]([S:25](=[O:26])(=[O:27])[CH3:28])[cH:23][cH:24]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:10]([cH:11]1)[CH2:9][NH:8][CH2:7][CH2:6]2>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:10]([cH:11]1)[CH2:9][N:8]([C:18]([c:17]1[c:16]([O:15][CH:12]([CH3:13])[CH3:14])[cH:24][cH:23][c:22]([S:25](=[O:26])(=[O:27])[CH3:28])[cH:21]1)=[O:19])[CH2:7][CH2:6]2

참가 물질

3

반응물 2

HCID 125950697-Chloro-1,2,3,4-tetrahydroisoquinolineHCID 211002372-Isopropoxy-5-methylsulfonylbenzoic acid

생성물 1

HCID 11517075(7-Chloro-3,4-dihydro-1H-isoquinolin-2-yl)-(2-isopropoxy-5-methanesulfonyl-phenyl)-methanone

출처 및 근거

ORD 기록
ord-1072cf12687b4b4199b6ce0df010ea9a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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