Pyridine → 3-(cyclopentylmethylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-carbothioamide

반응식

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

참가 물질

반응물 3

HCID 1049Pyridine

HCID 27871Dimethylthiocarbamoyl chloride

HCID 178527387HCID 178527387, 화합물

생성물 1

HCID 190269373-(cyclopentylmethylsulfonyl)-N,N-dimethyl-1,2,4-triazole-1-carbothioamide

출처 및 근거

ORD 기록: ord-2bb6566c24b64b0ea5a7a896beebdebf
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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