Tetrahydrofuran → 2,4-Dichloro-N-[1-cyano-1-methyl-2-(4,6,7-trichloro-2H-indazol-2-yl)ethyl]benzamide

반응식

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

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 666452,4-Dichlorobenzoyl chloride

HCID 666208912-Amino-2-methyl-3-(4,6,7-trichloro-2H-indazol-2-yl)propionitrile

생성물 1

HCID 687062942,4-Dichloro-N-[1-cyano-1-methyl-2-(4,6,7-trichloro-2H-indazol-2-yl)ethyl]benzamide

출처 및 근거

ORD 기록: ord-768fdae0925c49fd99af3df4aea4c493
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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