Dichloromethane → 6-Isothiocyanato-2,4-dimethylnicotinonitrile

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

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 8531621,1'-Thiocarbonyldi-2(1H)-pyridone

HCID 37932996-Amino-2,4-dimethyl-3-pyridinecarbonitrile

생성물 1

HCID 183162016-Isothiocyanato-2,4-dimethylnicotinonitrile

출처 및 근거

ORD 기록: ord-548c598869e8465c8971bab95222f00d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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