1,3-Indandione → 2-{[4-chloro-2-((E)-{4-[ethyl(2-hydroxyethyl)amino]-phenyl}diazenyl)-1,3-thiazol-5-yl]methylidene}-1H-indene-1,3(2H)-dione

반응식

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

참가 물질

반응물 2

HCID 118151,3-Indandione

HCID 21022615HCID 21022615, 화합물

생성물 1

HCID 866301622-{[4-chloro-2-((E)-{4-[ethyl(2-hydroxyethyl)amino]-phenyl}diazenyl)-1,3-thiazol-5-yl]methylidene}-1H-indene-1,3(2H)-dione

출처 및 근거

ORD 기록: ord-a36512239d0a4e0b98e6abcb0e61b389
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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