Acetone → 2-Butenedinitrile, 2-amino-3-[(1-cyanoethylidene)amino]-

HRID 98914노트

반응식

HRID 98914 반응식
[C:9]([CH3:10])(=[O:11])[C:12]#[N:13].[CH3:25][CH2:26][O:27][CH2:28][CH3:29].[CH3:30][C:31](=[O:32])[CH3:33].[NH2:1][C:2](=[C:3]([C:4]#[N:5])[NH2:6])[C:7]#[N:8].[c:14]1([CH3:15])[cH:16][cH:17][c:18]([S:19]([OH:20])(=[O:21])=[O:22])[cH:23][cH:24]1>>[NH2:1][C:2](=[C:3]([C:4]#[N:5])[N:6]=[C:9]([CH3:10])[C:12]#[N:13])[C:7]#[N:8]

참가 물질

6

출처 및 근거

ORD 기록
ord-ee796e85b7c642ff8f41d858ba2bff57
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

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