Pyridine → HCID 10075750, 화합물

반응식

[C:31]([c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1)(=[O:38])[Cl:39].[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:14][c:15]2[cH:16][cH:17][c:18](-[c:21]3[c:22]([S:27]([NH2:28])(=[O:29])=[O:30])[cH:23][cH:24][cH:25][cH:26]3)[cH:19][cH:20]2)[c:7](=[O:13])[n:8]([CH:10]([CH3:11])[CH3:12])[n:9]1.[cH:40]1[cH:41][cH:42][n:43][cH:44][cH:45]1>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:14][c:15]2[cH:16][cH:17][c:18](-[c:21]3[c:22]([S:27]([NH:28][C:31]([c:32]4[cH:33][cH:34][cH:35][cH:36][cH:37]4)=[O:38])(=[O:29])=[O:30])[cH:23][cH:24][cH:25][cH:26]3)[cH:19][cH:20]2)[c:7](=[O:13])[n:8]([CH:10]([CH3:11])[CH3:12])[n:9]1

참가 물질

반응물 3

HCID 1049Pyridine

HCID 7412Benzoyl chloride

HCID 152821035-n-Butyl-2,4-dihydro-2-isopropyl-4-[(2'-sulfamoylbiphenyl-4-yl)methyl]-3H-1,2,4-triazol-3-one

생성물 1

HCID 10075750HCID 10075750, 화합물

출처 및 근거

ORD 기록: ord-7aa2a74379c94a0aa5d1dfc19a362873
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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