Toluene → 1-[3-Chloro-4-(4-chloro-1-naphthoxy)-2,5-dimethylphenyl]-3-(2-chlorobenzoyl)urea

HRID 295078

반응식

HRID 295078 반응식
[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[Cl:1][c:2]1[c:3]([CH3:22])[c:4]([NH2:5])[cH:6][c:7]([CH3:21])[c:8]1[O:9][c:10]1[cH:11][cH:12][c:13]([Cl:20])[c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]12.[Cl:23][c:24]1[c:25]([C:26](=[O:27])[N:28]=[C:29]=[O:30])[cH:31][cH:32][cH:33][cH:34]1>>[Cl:1][c:2]1[c:3]([CH3:22])[c:4]([NH:5][C:29]([NH:28][C:26]([c:25]2[c:24]([Cl:23])[cH:34][cH:33][cH:32][cH:31]2)=[O:27])=[O:30])[cH:6][c:7]([CH3:21])[c:8]1[O:9][c:10]1[cH:11][cH:12][c:13]([Cl:20])[c:14]2[cH:15][cH:16][cH:17][cH:18][c:19]12

참가 물질

4

반응물 3

HCID 1140TolueneHCID 99423112-Chlorobenzoyl isocyanateHCID 132460063-Chloro-4-[(4-chloronaphthalen-1-yl)oxy]-2,5-dimethylaniline

생성물 1

HCID 132621251-[3-Chloro-4-(4-chloro-1-naphthoxy)-2,5-dimethylphenyl]-3-(2-chlorobenzoyl)urea

출처 및 근거

ORD 기록
ord-657527758bc34a86aefbfb4ab1e6ecc4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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