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Dichloromethane → N-[({2-[4-(3,5-dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethyl}amino)carbonyl]-4-methylbenzenesulfonamide

HRID 2323835
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HRID 2323835 반응식
[CH3:1][c:2]1[n:3][n:4](-[c:14]2[cH:15][cH:16][c:17]([CH2:20][CH2:21][NH2:22])[cH:18][cH:19]2)[c:5]([CH3:13])[c:6]1-[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1.[Cl:36][CH2:37][Cl:38].[c:23]1([CH3:35])[cH:24][cH:25][c:26]([S:29](=[O:30])(=[O:31])[N:32]=[C:33]=[O:34])[cH:27][cH:28]1>>[CH3:1][c:2]1[n:3][n:4](-[c:14]2[cH:15][cH:16][c:17]([CH2:20][CH2:21][NH:22][C:33]([NH:32][S:29]([c:26]3[cH:25][cH:24][c:23]([CH3:35])[cH:28][cH:27]3)(=[O:30])=[O:31])=[O:34])[cH:18][cH:19]2)[c:5]([CH3:13])[c:6]1-[c:7]1[cH:8][cH:9][cH:10][cH:11][cH:12]1
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반응물 3

HCID 6344DichloromethaneHCID 77703p-Toluenesulfonyl isocyanateHCID 222446652-[4-(3,5-Dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethylamine

생성물 1

HCID 10239013N-[({2-[4-(3,5-dimethyl-4-phenyl-1H-pyrazol-1-yl)phenyl]ethyl}amino)carbonyl]-4-methylbenzenesulfonamide

출처 및 근거

ORD 기록
ord-8b7a5878722945328012a2fefdf978b5
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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