Benzenesulfonic Acid → 2-[(4-Ethoxycarbonylbicyclo[2.2.2]oct-1-yl)amino]acetyl-4-fluoropyrrolidine-2-carbonitrile

HRID 953065

반응식

HRID 953065 반응식
[F:25][CH:26]1[CH2:27][CH:28]([C:44]#[N:45])[N:29]([C:31]([CH2:32][O:33][S:34]([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)(=[O:41])=[O:42])=[O:43])[CH2:30]1.[NH2:11][C:12]12[CH2:13][CH2:14][C:15]([C:20](=[O:21])[O:22][CH2:23][CH3:24])([CH2:16][CH2:17]1)[CH2:18][CH2:19]2.[c:1]1([S:2]([OH:3])(=[O:4])=[O:5])[cH:6][cH:7][cH:8][cH:9][cH:10]1>>[NH:11]([C:12]12[CH2:13][CH2:14][C:15]([C:20](=[O:21])[O:22][CH2:23][CH3:24])([CH2:16][CH2:17]1)[CH2:18][CH2:19]2)[CH2:32][C:31]([N:29]1[CH:28]([C:44]#[N:45])[CH2:27][CH:26]([F:25])[CH2:30]1)=[O:43]

참가 물질

4

반응물 3

HCID 7371Benzenesulfonic AcidHCID 23149693Ethyl 4-aminobicyclo[2.2.2]octane-1-carboxylateHCID 150304301[2-(2-Cyano-4-fluoropyrrolidin-1-yl)-2-oxoethyl] benzenesulfonate

생성물 1

HCID 231496942-[(4-Ethoxycarbonylbicyclo[2.2.2]oct-1-yl)amino]acetyl-4-fluoropyrrolidine-2-carbonitrile

출처 및 근거

ORD 기록
ord-aa766c1bf335493586bac0df31d40e3a
출처 데이터셋
Validation data from https://doi.org/10.1039/C8SC04228D

연결된 노트

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