Ethyl Acetate → HCID 178491731, 화합물

반응식

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

참가 물질

반응물 3

HCID 8857Ethyl Acetate

HCID 12212046Phenoxycarbonyl isothiocyanate

HCID 205771932-Cyano-thioacetimidic acid 4-methoxy-benzyl ester

생성물 1

HCID 178491731HCID 178491731, 화합물

출처 및 근거

ORD 기록: ord-6020a9be53214ec28bb23ee277f4bc5f
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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