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Water → N-benzooxazol-2-yl-2-(3-chloro-4-methanesulfonyl-phenyl)-3-cyclopentyl-propionamide

HRID 192270
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HRID 192270 반응식
[Br:20][N:21]1[C:22](=[O:23])[CH2:24][CH2:25][C:26]1=[O:27].[CH2:65]([Cl:66])[Cl:67].[Cl:28][c:29]1[cH:30][c:31]([CH:39]([C:40](=[O:41])[OH:42])[CH2:43][CH:44]2[CH2:45][CH2:46][CH2:47][CH2:48]2)[cH:32][cH:33][c:34]1[S:35](=[O:36])(=[O:37])[CH3:38].[NH2:49][c:50]1[o:51][c:52]2[c:53]([n:54]1)[cH:55][cH:56][cH:57][cH:58]2.[OH2:68].[c:1]1([P:2]([c:3]2[cH:4][cH:5][cH:6][cH:7][cH:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1.[cH:59]1[cH:60][cH:61][n:62][cH:63][cH:64]1>>[Cl:28][c:29]1[cH:30][c:31]([CH:39]([C:40](=[O:42])[NH:49][c:50]2[o:51][c:52]3[c:53]([n:54]2)[cH:55][cH:56][cH:57][cH:58]3)[CH2:43][CH:44]2[CH2:45][CH2:46][CH2:47][CH2:48]2)[cH:32][cH:33][c:34]1[S:35](=[O:36])(=[O:37])[CH3:38]
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 962WaterHCID 1049PyridineHCID 6344DichloromethaneHCID 11776TriphenylphosphineHCID 207072-AminobenzoxazoleHCID 67184N-bromobutanimideHCID 120676542-(3-Chloro-4-methanesulfonyl-phenyl)-3-cyclopentyl-propionic acid

생성물 1

HCID 10138559N-benzooxazol-2-yl-2-(3-chloro-4-methanesulfonyl-phenyl)-3-cyclopentyl-propionamide

출처 및 근거

ORD 기록
ord-6992bbc8dbd844638d81cead5ca22ab6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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