Benzenesulfonyl isocyanate, 2-chloro- → 3-(4-{2-[({[(2-CHLOROPHENYL)SULFONYL]AMINO}CARBONYL)AMINO]ETHYL}PHENYL)-2-ETHYL-5,7-DIMETHYL-3H-IMIDAZO[4,5-b]PYRIDINE

HRID 283701

반응식

HRID 283701 반응식
[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7][c:8]([CH3:12])[cH:9][c:10]2[CH3:11])[n:13]1-[c:14]1[cH:15][cH:16][c:17]([CH2:20][CH2:21][NH2:22])[cH:18][cH:19]1.[Cl:23][c:24]1[c:25]([S:30](=[O:31])(=[O:32])[N:33]=[C:34]=[O:35])[cH:26][cH:27][cH:28][cH:29]1>>[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7][c:8]([CH3:12])[cH:9][c:10]2[CH3:11])[n:13]1-[c:14]1[cH:15][cH:16][c:17]([CH2:20][CH2:21][NH:22][C:34]([NH:33][S:30]([c:25]2[c:24]([Cl:23])[cH:29][cH:28][cH:27][cH:26]2)(=[O:31])=[O:32])=[O:35])[cH:18][cH:19]1

참가 물질

3

반응물 2

HCID 174071Benzenesulfonyl isocyanate, 2-chloro-HCID 218763642-[4-(2-ethyl-5,7-dimethyl-3H-imidazo[4,5-b]pyridin-3-yl)phenyl]ethylamine

생성물 1

HCID 218756523-(4-{2-[({[(2-CHLOROPHENYL)SULFONYL]AMINO}CARBONYL)AMINO]ETHYL}PHENYL)-2-ETHYL-5,7-DIMETHYL-3H-IMIDAZO[4,5-b]PYRIDINE

출처 및 근거

ORD 기록
ord-b2f3630d695547d781120996710bd9d6
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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