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Dichloromethane → tert-butyl N-[4-[3-[2-methyl-6-(4-methylsulfonylbutanoylamino)phenyl]phenyl]sulfonyl-5-methylsulfanylthiophene-2-carboximidoyl]carbamate

HRID 1564748
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HRID 1564748 반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8](=[NH:9])[c:10]1[s:11][c:12]([S:32][CH3:33])[c:13]([S:15](=[O:16])(=[O:17])[c:18]2[cH:19][c:20](-[c:24]3[c:25]([NH2:31])[cH:26][cH:27][cH:28][c:29]3[CH3:30])[cH:21][cH:22][cH:23]2)[cH:14]1)=[O:34].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:42][S:43](=[O:44])(=[O:45])[CH2:46][CH2:47][CH2:48][C:49](=[O:50])[Cl:51].[Cl:52][CH2:53][Cl:54]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8](=[NH:9])[c:10]1[s:11][c:12]([S:32][CH3:33])[c:13]([S:15](=[O:16])(=[O:17])[c:18]2[cH:19][c:20](-[c:24]3[c:25]([NH:31][C:49]([CH2:48][CH2:47][CH2:46][S:43]([CH3:42])(=[O:44])=[O:45])=[O:50])[cH:26][cH:27][cH:28][c:29]3[CH3:30])[cH:21][cH:22][cH:23]2)[cH:14]1)=[O:34]
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 218866174-Methanesulfonyl-butyryl chlorideHCID 145857623tert-butyl N-[4-[3-(2-amino-6-methylphenyl)phenyl]sulfonyl-5-methylsulfanylthiophene-2-carboximidoyl]carbamate

생성물 1

HCID 145857696tert-butyl N-[4-[3-[2-methyl-6-(4-methylsulfonylbutanoylamino)phenyl]phenyl]sulfonyl-5-methylsulfanylthiophene-2-carboximidoyl]carbamate

출처 및 근거

ORD 기록
ord-6cba9801657247a3b9cb0781d6ee15cf
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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