Chloride → HCID 10146280, 화합물

반응식

[C:36]([CH3:37])(=[O:38])[NH:39][c:40]1[cH:41][cH:42][c:43]([S:46](=[O:47])(=[O:48])[OH:49])[cH:44][cH:45]1.[CH:1]([CH3:2])([CH3:3])[O:4][C:5]([CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][O:11][c:12]1[c:13]([NH2:33])[cH:14][c:15]2[c:16]([n:17](-[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:18](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[n:19]2)[cH:32]1)=[O:34].[Cl-:35]>>[CH:1]([CH3:2])([CH3:3])[O:4][C:5]([CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][O:11][c:12]1[c:13]([NH:33][S:46]([c:43]2[cH:42][cH:41][c:40]([NH:39][C:36]([CH3:37])=[O:38])[cH:45][cH:44]2)(=[O:47])=[O:48])[cH:14][c:15]2[c:16]([n:17](-[c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)[c:18](-[c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[n:19]2)[cH:32]1)=[O:34]

참가 물질

반응물 3

HCID 312Chloride

HCID 8483N-Acetylsulfanilic acid

HCID 673640426-[(5-Amino-1,2-diphenyl-1H-benzimidazol-6-yl)oxy]hexanoic acid isopropyl ester

생성물 1

HCID 10146280HCID 10146280, 화합물

출처 및 근거

ORD 기록: ord-8f30189e77aa40b6bd8dc05b17ca1371
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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