4-(Pyridin-3-yl)aniline → [7-(3-Methanesulfonyl-phenyl)-pyrrolo[2,1-f][1,2,4]triazin-2-yl]-(4-pyridin-3-yl-phenyl)-amine

반응식

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

참가 물질

반응물 2

HCID 4595224-(Pyridin-3-yl)aniline

HCID 178504720HCID 178504720, 화합물

생성물 1

HCID 66711349[7-(3-Methanesulfonyl-phenyl)-pyrrolo[2,1-f][1,2,4]triazin-2-yl]-(4-pyridin-3-yl-phenyl)-amine

출처 및 근거

ORD 기록: ord-c89bfa0e4e3b45d9977afe10381ebb9e
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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