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Methane → 3-Methanesulfonyl-4-(3-methyl-benzo[b]thiophene-2-sulfonylamino)-benzoic acid methyl ester

HRID 308521
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HRID 308521 반응식
[C:32].[CH3:1][OH:2].[Cl:3][c:4]1[cH:5][c:6]2[c:7]([s:8][c:9]([S:12](=[O:13])(=[O:14])[NH:15][c:16]3[c:17]([S:26](=[O:27])(=[O:28])[CH3:29])[cH:18][c:19]([C:20](=[O:21])[O:22][CH3:23])[cH:24][cH:25]3)[c:10]2[CH3:11])[cH:30][cH:31]1.[O:34]1[CH2:35][CH2:36][O:37][CH2:38][CH2:39]1.[Pd:33]>>[cH:4]1[cH:5][c:6]2[c:7]([s:8][c:9]([S:12](=[O:13])(=[O:14])[NH:15][c:16]3[c:17]([S:26](=[O:27])(=[O:28])[CH3:29])[cH:18][c:19]([C:20](=[O:21])[O:22][CH3:23])[cH:24][cH:25]3)[c:10]2[CH3:11])[cH:30][cH:31]1
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반응물 5

HCID 297MethaneHCID 887MethanolHCID 23938PalladiumHCID 312751,4-DioxaneHCID 101624624-(5-Chloro-3-methyl-benzo[b]thiophene-2-sulfonylamino)-3-methanesulfonyl-benzoic acid methyl ester

생성물 1

HCID 120451403-Methanesulfonyl-4-(3-methyl-benzo[b]thiophene-2-sulfonylamino)-benzoic acid methyl ester

출처 및 근거

ORD 기록
ord-8a90d8ae2d4b4b8db053844036fa29eb
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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