2-Tert-butyl-4-[4-(3-chloro-propyl)-piperazin-1-yl]-6-difluoromethyl-pyrimidine → Hydrochloric Acid

HRID 2315259노트

반응식

HRID 2315259 반응식
[C:10]([CH3:11])([CH3:12])([CH3:13])[c:14]1[n:15][c:16]([CH:30]([F:31])[F:32])[cH:17][c:18]([N:20]2[CH2:21][CH2:22][N:23]([CH2:26][CH2:27][CH2:28][Cl:29])[CH2:24][CH2:25]2)[n:19]1.[CH3:1][n:2]1[c:3]([SH:9])[n:4][n:5][c:6]1[CH2:7][CH3:8]>>[CH3:1][n:2]1[c:3]([S:9][CH2:28][CH2:27][CH2:26][N:23]2[CH2:22][CH2:21][N:20]([c:18]3[cH:17][c:16]([CH:30]([F:31])[F:32])[n:15][c:14]([C:10]([CH3:11])([CH3:12])[CH3:13])[n:19]3)[CH2:25][CH2:24]2)[n:4][n:5][c:6]1[CH2:7][CH3:8].[ClH:29]

참가 물질

4

반응물 2

HCID 223498752-Tert-butyl-4-[4-(3-chloro-propyl)-piperazin-1-yl]-6-difluoromethyl-pyrimidineHCID 178437978HCID 178437978, 화합물

생성물 2

HCID 313Hydrochloric AcidHCID 666745622-Tert-butyl-4-(difluoromethyl)-6-[4-[3-[(5-ethyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propyl]piperazin-1-yl]pyrimidine

출처 및 근거

ORD 기록
ord-4e7fc95b69fc46a5a2c40aaf853936fd
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

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