Toluene → HCID 66643945, 화합물

반응식

[CH3:1][O:2][C:3](=[O:4])[c:5]1[n:6][n:7][c:8]([O:11][CH2:12][c:13]2[c:14]([CH2:19][CH2:20][CH2:21][CH3:22])[n:15][o:16][c:17]2[CH3:18])[cH:9][cH:10]1.[CH3:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[NH2:23][CH2:24][C:25]([CH3:26])([OH:27])[CH3:28]>>[C:3](=[O:4])([c:5]1[n:6][n:7][c:8]([O:11][CH2:12][c:13]2[c:14]([CH2:19][CH2:20][CH2:21][CH3:22])[n:15][o:16][c:17]2[CH3:18])[cH:9][cH:10]1)[NH:23][CH2:24][C:25]([CH3:26])([OH:27])[CH3:28]

참가 물질

반응물 3

HCID 1140Toluene

HCID 951022-Propanol, 1-amino-2-methyl-

HCID 666438716-(3-Butyl-5-methyl-isoxazol-4-ylmethoxy)-pyridazine-3-carboxylic acid methyl ester

생성물 1

HCID 66643945HCID 66643945, 화합물

출처 및 근거

ORD 기록: ord-4bc56831b44f4cb1b3c35a11404cb2a1
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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