Hexane → 3-Carbethoxy-4-(4-chloro-2-fluorophenylaminocarbonyl)thiomorpholine

HRID 686241

반응식

HRID 686241 반응식
[C:1](=[O:2])([O:3][CH2:4][CH3:5])[CH:6]1[CH2:7][S:8][CH2:9][CH2:10][NH:11]1.[CH3:23][CH2:24][CH2:25][CH2:26][CH2:27][CH3:28].[Cl:12][c:13]1[cH:14][c:15]([F:22])[c:16]([N:19]=[C:20]=[O:21])[cH:17][cH:18]1>>[C:1](=[O:2])([O:3][CH2:4][CH3:5])[CH:6]1[CH2:7][S:8][CH2:9][CH2:10][N:11]1[C:20]([NH:19][c:16]1[c:15]([F:22])[cH:14][c:13]([Cl:12])[cH:18][cH:17]1)=[O:21]

참가 물질

4

반응물 3

HCID 8058HexaneHCID 45582034-Chloro-2-fluorophenyl isocyanateHCID 13604869Ethyl thiomorpholine-3-carboxylate

생성물 1

HCID 233433973-Carbethoxy-4-(4-chloro-2-fluorophenylaminocarbonyl)thiomorpholine

출처 및 근거

ORD 기록
ord-aa3047d47a454078a9e465483d3c44e4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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