Tetrahydrofuran → 5-n-Propyl-5-(1-methylethyl)-3-(3,5-dichlorophenyl)-2-thio-hydantoin

반응식

[Cl:1][c:2]1[cH:3][c:4]([N:9]=[C:10]=[S:11])[cH:5][c:6]([Cl:8])[cH:7]1.[NH2:12][C:13]([C:14](=[O:15])[O:16][CH3:17])([CH2:18][CH2:19][CH3:20])[CH:21]([CH3:22])[CH3:23].[O:24]1[CH2:25][CH2:26][CH2:27][CH2:28]1>>[Cl:1][c:2]1[cH:3][c:4]([N:9]2[C:10](=[S:11])[NH:12][C:13]([CH2:18][CH2:19][CH3:20])([CH:21]([CH3:22])[CH3:23])[C:14]2=[O:15])[cH:5][c:6]([Cl:8])[cH:7]1

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 1387763,5-Dichlorophenyl isothiocyanate

HCID 13314519Methyl 2-amino-2-(1-methylethyl)-pentanoate

생성물 1

HCID 133147905-n-Propyl-5-(1-methylethyl)-3-(3,5-dichlorophenyl)-2-thio-hydantoin

출처 및 근거

ORD 기록: ord-b8ab4965bd8e4db89c05700a8927e963
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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