Chloride → 6-[[5-[[(4-Chlorophenyl)sulfonyl]amino]-1-(4-methylphenyl)-2-phenyl-1H-benzimidazol-6-yl]oxy]hexanoic acid methyl ester

HRID 138824

반응식

HRID 138824 반응식
[CH3:1][O:2][C:3]([CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][O:9][c:10]1[c:11]([NH2:32])[cH:12][c:13]2[c:14]([n:15](-[c:24]3[cH:25][cH:26][c:27]([CH3:30])[cH:28][cH:29]3)[c:16](-[c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[n:17]2)[cH:31]1)=[O:33].[Cl-:34].[Cl:35][c:36]1[cH:37][cH:38][c:39]([S:42](=[O:43])(=[O:44])[OH:45])[cH:40][cH:41]1>>[CH3:1][O:2][C:3]([CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][O:9][c:10]1[c:11]([NH:32][S:42]([c:39]2[cH:38][cH:37][c:36]([Cl:35])[cH:41][cH:40]2)(=[O:43])=[O:44])[cH:12][c:13]2[c:14]([n:15](-[c:24]3[cH:25][cH:26][c:27]([CH3:30])[cH:28][cH:29]3)[c:16](-[c:18]3[cH:19][cH:20][cH:21][cH:22][cH:23]3)[n:17]2)[cH:31]1)=[O:33]

참가 물질

4

반응물 3

HCID 312ChlorideHCID 7400p-Chlorobenzenesulfonic acidHCID 673657096-[(5-Amino-1-(4-methylphenyl)-2-phenyl-1H-benzimidazol-6-yl)oxy]hexanoic acid methyl ester

생성물 1

HCID 102327406-[[5-[[(4-Chlorophenyl)sulfonyl]amino]-1-(4-methylphenyl)-2-phenyl-1H-benzimidazol-6-yl]oxy]hexanoic acid methyl ester

출처 및 근거

ORD 기록
ord-1cd91f03e47c40f18fb5b6f8ec2199fe
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

연결된 노트

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