Toluene → HCID 178449870, 화합물

HRID 122225

반응식

HRID 122225 반응식
[Br:1][c:2]1[cH:3][cH:4][c:5]([NH2:6])[cH:7][cH:8]1.[CH3:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[F:9][c:10]1[c:11]([C:16]([C:17]#[N:18])([CH3:19])[CH3:20])[cH:12][cH:13][cH:14][cH:15]1>>[Br:1][c:2]1[cH:3][cH:4][c:5]([NH:6][C:17]([C:16]([c:11]2[c:10]([F:9])[cH:15][cH:14][cH:13][cH:12]2)([CH3:19])[CH3:20])=[NH:18])[cH:7][cH:8]1

참가 물질

4

출처 및 근거

ORD 기록
ord-cbec13e4df0743d180b5bb2aced81c11
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

불러오는 중…