5-Bromo-benzo[2,1,3]thiadiazole → 5-[2-(Pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]benzo[2,1,3]thiadiazole

반응식

[Br:1][c:2]1[cH:3][c:4]2[c:5]([n:6][s:7][n:8]2)[cH:9][cH:10]1.[n:11]1[c:12](-[c:17]2[c:18]([B:25]([OH:26])[OH:27])[c:19]3[n:20]([n:21]2)[CH2:22][CH2:23][CH2:24]3)[cH:13][cH:14][cH:15][cH:16]1>>[c:2]1(-[c:18]2[c:17](-[c:12]3[n:11][cH:16][cH:15][cH:14][cH:13]3)[n:21][n:20]3[c:19]2[CH2:24][CH2:23][CH2:22]3)[cH:3][c:4]2[c:5]([n:6][s:7][n:8]2)[cH:9][cH:10]1

참가 물질

반응물 2

HCID 27762955-Bromo-benzo[2,1,3]thiadiazole

HCID 59710031(2-pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole-3-boronic acid

생성물 1

HCID 117234765-[2-(Pyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]benzo[2,1,3]thiadiazole

출처 및 근거

ORD 기록: ord-fb810b76053c45b8924945bbdb212059
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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