Ethyl Acetate → 1-(3,5-Dichlorophenyl)-3-[2-methoxy-5-(phenylsulfamoyl)phenyl]thiourea

반응식

[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36].[Cl:20][c:21]1[cH:22][c:23]([N:28]=[C:29]=[S:30])[cH:24][c:25]([Cl:27])[cH:26]1.[NH2:1][c:2]1[cH:3][c:4]([S:10](=[O:11])(=[O:12])[NH:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:5][cH:6][c:7]1[O:8][CH3:9]>>[NH:1]([c:2]1[cH:3][c:4]([S:10](=[O:11])(=[O:12])[NH:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[cH:5][cH:6][c:7]1[O:8][CH3:9])[C:29]([NH:28][c:23]1[cH:22][c:21]([Cl:20])[cH:26][c:25]([Cl:27])[cH:24]1)=[S:30]

참가 물질

반응물 3

HCID 8857Ethyl Acetate

HCID 1387763,5-Dichlorophenyl isothiocyanate

HCID 155386383-amino-4-methoxy-N-phenylbenzene-1-sulfonamide

생성물 1

HCID 544931261-(3,5-Dichlorophenyl)-3-[2-methoxy-5-(phenylsulfamoyl)phenyl]thiourea

출처 및 근거

ORD 기록: ord-cfbfeac822f549beaf749ab466efd91b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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