2-Chlorobenzenesulfonamide → 4-[[3,6-bis(3-oxo-3-pyrrolidin-1-ylprop-1-enyl)indol-1-yl]methyl]-N-(2-chlorophenyl)sulfonyl-3-methoxybenzamide

반응식

[Cl:40][c:41]1[c:42]([S:47](=[O:48])(=[O:49])[NH2:50])[cH:43][cH:44][cH:45][cH:46]1.[O:1]=[C:2]([CH:3]=[CH:4][c:5]1[cH:6][n:7]([CH2:23][c:24]2[c:25]([O:33][CH3:34])[cH:26][c:27]([C:28](=[O:29])[OH:30])[cH:31][cH:32]2)[c:8]2[cH:9][c:10]([CH:14]=[CH:15][C:16](=[O:17])[N:18]3[CH2:19][CH2:20][CH2:21][CH2:22]3)[cH:11][cH:12][c:13]12)[N:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1>>[O:1]=[C:2]([CH:3]=[CH:4][c:5]1[cH:6][n:7]([CH2:23][c:24]2[c:25]([O:33][CH3:34])[cH:26][c:27]([C:28](=[O:30])[NH:50][S:47]([c:42]3[c:41]([Cl:40])[cH:46][cH:45][cH:44][cH:43]3)(=[O:48])=[O:49])[cH:31][cH:32]2)[c:8]2[cH:9][c:10]([CH:14]=[CH:15][C:16](=[O:17])[N:18]3[CH2:19][CH2:20][CH2:21][CH2:22]3)[cH:11][cH:12][c:13]12)[N:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1

참가 물질

반응물 2

HCID 814102-Chlorobenzenesulfonamide

HCID 540551284-[[3,6-Bis(3-oxo-3-pyrrolidin-1-ylprop-1-enyl)indol-1-yl]methyl]-3-methoxybenzoic acid

생성물 1

HCID 543287084-[[3,6-bis(3-oxo-3-pyrrolidin-1-ylprop-1-enyl)indol-1-yl]methyl]-N-(2-chlorophenyl)sulfonyl-3-methoxybenzamide

출처 및 근거

ORD 기록: ord-043ef1b3c5b649d1bedace8c74861bb1
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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