Acetone → 3-(3-Acetylthioureido)-4-(3-carbomethoxythioureido)benzophenone

반응식

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

참가 물질

반응물 3

HCID 180Acetone

HCID 552246Methoxycarbonyl isothiocyanate

HCID 130231783-(3-Acetylthioureido)-4-aminobenzophenone

생성물 1

HCID 130231803-(3-Acetylthioureido)-4-(3-carbomethoxythioureido)benzophenone

출처 및 근거

ORD 기록: ord-044a0531f8b54fd887fc213f7d32a96d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…