4-Isopropylcyclohexanone → HCID 54756040, 화합물

HRID 1123741노트

반응식

HRID 1123741 반응식
[CH:23]([CH3:24])([CH3:25])[CH:26]1[CH2:27][CH2:28][C:29](=[O:32])[CH2:30][CH2:31]1.[NH:1]1[CH2:2][CH:3]([NH:5][C:6]([CH2:7][NH:8][c:9]2[n:10][o:11][c:12]3[c:13]2[cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]3)=[O:22])[CH2:4]1>>[N:1]1([CH:29]2[CH2:28][CH2:27][CH:26]([CH:23]([CH3:24])[CH3:25])[CH2:31][CH2:30]2)[CH2:2][CH:3]([NH:5][C:6]([CH2:7][NH:8][c:9]2[n:10][o:11][c:12]3[c:13]2[cH:14][c:15]([C:18]([F:19])([F:20])[F:21])[cH:16][cH:17]3)=[O:22])[CH2:4]1

참가 물질

3

반응물 2

HCID 794884-IsopropylcyclohexanoneHCID 58548680N-azetidin-3-yl-2-(5-trifluoromethyl-benzo[d]isoxazol-3-ylamino)-acetamide

생성물 1

HCID 54756040HCID 54756040, 화합물

출처 및 근거

ORD 기록
ord-f331f634e5814fb6a06d0f54807bcb87
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

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