Cyclopropylamine → 8-(2-Cyclopropylamino-pyridine-3-sulfonyl)-2-(4-trifluoromethoxy-phenyl)-2,8-diaza-spiro[4.5]decan-1-one

반응식

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

참가 물질

반응물 2

HCID 69828Cyclopropylamine

HCID 595779608-(2-Chloro-pyridine-3-sulfonyl)-2-(4-trifluoromethoxy-phenyl)-2,8-diaza-spiro[4.5]decan-1-one

생성물 1

HCID 595778878-(2-Cyclopropylamino-pyridine-3-sulfonyl)-2-(4-trifluoromethoxy-phenyl)-2,8-diaza-spiro[4.5]decan-1-one

출처 및 근거

ORD 기록: ord-ed14a85e118642bba4c09d94c55b37c3
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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