1,4-Dioxane → HCID 58677596, 화합물

HRID 292579

반응식

HRID 292579 반응식
[C:27](#[N:28])[c:29]1[cH:30][c:31]([N:35]=[C:36]=[O:37])[cH:32][cH:33][cH:34]1.[NH2:1][c:2]1[cH:3][cH:4][c:5]([CH3:26])[c:6]([C:8](=[O:9])[c:10]2[c:11]([Cl:25])[cH:12][c:13]([NH:16][c:17]3[c:18]([F:24])[cH:19][c:20]([F:23])[cH:21][cH:22]3)[cH:14][cH:15]2)[cH:7]1.[O:38]1[CH2:39][CH2:40][O:41][CH2:42][CH2:43]1>>[NH:1]([c:2]1[cH:3][cH:4][c:5]([CH3:26])[c:6]([C:8](=[O:9])[c:10]2[c:11]([Cl:25])[cH:12][c:13]([NH:16][c:17]3[c:18]([F:24])[cH:19][c:20]([F:23])[cH:21][cH:22]3)[cH:14][cH:15]2)[cH:7]1)[C:36]([NH:35][c:31]1[cH:30][c:29]([C:27]#[N:28])[cH:34][cH:33][cH:32]1)=[O:37]

참가 물질

4

반응물 3

HCID 312751,4-DioxaneHCID 27333153-IsocyanatobenzonitrileHCID 11538012(5-Amino-2-methyl-phenyl)-[2-chloro-4-(2,4-difluoro-phenylamino)-phenyl]-methanone

생성물 1

HCID 58677596HCID 58677596, 화합물

출처 및 근거

ORD 기록
ord-5d4af717d35c4c169d0bf5ac9d1e98f8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

연결된 노트

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