Dimethyl Sulfoxide → (2-Nitro-5-pyrrolidin-1-yl-4-trifluoromethyl-phenyl)-carbamic acid tert-butyl ester

HRID 126022

반응식

[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([N+:19](=[O:20])[O-:21])[cH:10][c:11]([C:15]([F:16])([F:17])[F:18])[c:12]([Cl:14])[cH:13]1)=[O:22].[CH2:23]1[CH2:24][CH2:25][NH:26][CH2:27]1.[CH3:28][S:29]([CH3:30])=[O:31]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([N+:19](=[O:20])[O-:21])[cH:10][c:11]([C:15]([F:16])([F:17])[F:18])[c:12]([N:26]2[CH2:25][CH2:24][CH2:23][CH2:27]2)[cH:13]1)=[O:22]

참가 물질

반응물 3

HCID 679Dimethyl Sulfoxide

HCID 31268Pyrrolidine

HCID 69489376(5-Chloro-2-nitro-4-trifluoromethyl-phenyl)-carbamic acid tert-butyl ester

생성물 1

HCID 69486800(2-Nitro-5-pyrrolidin-1-yl-4-trifluoromethyl-phenyl)-carbamic acid tert-butyl ester

출처 및 근거

ORD 기록: ord-f736cf7d075d419a9b649958263aeafc
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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