1-(3-Methyl-1,2,4-thiadiazol-5-yl)piperidin-4-one → [8-(4-Fluoro-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-[1-(3-methyl-[1,2,4]thiadiazol-5-yl)-piperidin-4-yl]-amine

반응식

[CH3:1][c:2]1[n:3][s:4][c:5]([N:7]2[CH2:8][CH2:9][C:10](=[O:13])[CH2:11][CH2:12]2)[n:6]1.[F:14][c:15]1[cH:16][cH:17][c:18](-[c:21]2[c:22]3[n:23]([cH:24][cH:25][cH:26]2)[n:27][c:28]([NH2:30])[n:29]3)[cH:19][cH:20]1>>[CH3:1][c:2]1[n:3][s:4][c:5]([N:7]2[CH2:8][CH2:9][CH:10]([NH:30][c:28]3[n:27][n:23]4[c:22]([c:21](-[c:18]5[cH:17][cH:16][c:15]([F:14])[cH:20][cH:19]5)[cH:26][cH:25][cH:24]4)[n:29]3)[CH2:11][CH2:12]2)[n:6]1

참가 물질

반응물 2

HCID 592585101-(3-Methyl-1,2,4-thiadiazol-5-yl)piperidin-4-one

HCID 673360828-(4-Fluoro-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-ylamine

생성물 1

HCID 53354633[8-(4-Fluoro-phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]-[1-(3-methyl-[1,2,4]thiadiazol-5-yl)-piperidin-4-yl]-amine

출처 및 근거

ORD 기록: ord-802e1be905ee46359d7162f97b20b9a4
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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