Dichloromethane → 1-(5-Methyl-1-pyridin-4-ylmethyl-1H-benzoimidazol-4-yl)-3-(4-methyl-3-trifluoromethyl-phenyl)-urea

HRID 2150463

반응식

HRID 2150463 반응식
[CH3:1][c:2]1[c:3]([NH2:18])[c:4]2[c:5]([n:6]([CH2:9][c:10]3[cH:11][cH:12][n:13][cH:14][cH:15]3)[cH:7][n:8]2)[cH:16][cH:17]1.[Cl:33][CH2:34][Cl:35].[N:19](=[C:20]=[O:21])[c:22]1[cH:23][c:24]([C:29]([F:30])([F:31])[F:32])[c:25]([CH3:28])[cH:26][cH:27]1>>[CH3:1][c:2]1[c:3]([NH:18][C:20]([NH:19][c:22]2[cH:23][c:24]([C:29]([F:30])([F:31])[F:32])[c:25]([CH3:28])[cH:26][cH:27]2)=[O:21])[c:4]2[c:5]([n:6]([CH2:9][c:10]3[cH:11][cH:12][n:13][cH:14][cH:15]3)[cH:7][n:8]2)[cH:16][cH:17]1

참가 물질

4

반응물 3

HCID 6344DichloromethaneHCID 34491703-(Trifluoromethyl)-4-methylphenyl IsocyanateHCID 594286405-Methyl-1-(pyridin-4-yl)methyl-1H-benzimidazol-4-ylamine

생성물 1

HCID 498059661-(5-Methyl-1-pyridin-4-ylmethyl-1H-benzoimidazol-4-yl)-3-(4-methyl-3-trifluoromethyl-phenyl)-urea

출처 및 근거

ORD 기록
ord-49eba36882714943b0d2f28790bbe948
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

연결된 노트

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