Acetone → 8-Benzoylthiocarbamoylamino-3-methyl-5,6,7,8-tetrahydroquinoline

반응식

[C:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)(=[O:20])[N:21]=[C:22]=[S:23].[CH3:24][C:25](=[O:26])[CH3:27].[NH2:1][CH:2]1[CH2:3][CH2:4][CH2:5][c:6]2[cH:7][c:8]([CH3:12])[cH:9][n:10][c:11]21>>[NH:1]([CH:2]1[CH2:3][CH2:4][CH2:5][c:6]2[cH:7][c:8]([CH3:12])[cH:9][n:10][c:11]21)[C:22]([NH:21][C:13]([c:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1)=[O:20])=[S:23]

참가 물질

반응물 3

HCID 180Acetone

HCID 68284Benzoyl isothiocyanate

HCID 123582203-Methyl-5,6,7,8-tetrahydroquinolin-8-amine

생성물 1

HCID 123582458-Benzoylthiocarbamoylamino-3-methyl-5,6,7,8-tetrahydroquinoline

출처 및 근거

ORD 기록: ord-85b99e276d914682aefbae79ce429761
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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