Dimethylacetamide → 3-[7-(benzyloxy)-1,1-dioxido-4H-1,2,4-benzothiadiazin-3-yl]-1-{[cyclopropylmethylene]amino}-4-hydroxyquinolin-2(1H)-one

HRID 671490

반응식

HRID 671490 반응식
[CH3:39][N:40]([CH3:41])[C:42](=[O:43])[CH3:44].[CH:34]1([CH:37]=[O:38])[CH2:35][CH2:36]1.[NH2:1][n:2]1[c:3](=[O:33])[c:4]([C:13]2=[N:14][S:15](=[O:31])(=[O:32])[c:16]3[c:17]([cH:19][cH:20][c:21]([O:23][CH2:24][c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[cH:22]3)[NH:18]2)[c:5]([OH:12])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12>>[N:1]([n:2]1[c:3](=[O:33])[c:4]([C:13]2=[N:14][S:15](=[O:31])(=[O:32])[c:16]3[c:17]([cH:19][cH:20][c:21]([O:23][CH2:24][c:25]4[cH:26][cH:27][cH:28][cH:29][cH:30]4)[cH:22]3)[NH:18]2)[c:5]([OH:12])[c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]12)=[CH:37][CH:34]1[CH2:35][CH2:36]1

참가 물질

4

반응물 3

HCID 31374DimethylacetamideHCID 123114CyclopropanecarboxaldehydeHCID 1363584841-amino-3-[7-(benzyloxy)-1,1-dioxido-4H-1,2,4-benzothiadiazin-3-yl]-4-hydroxyquinolin-2(1H)-one

생성물 1

HCID 1363584863-[7-(benzyloxy)-1,1-dioxido-4H-1,2,4-benzothiadiazin-3-yl]-1-{[cyclopropylmethylene]amino}-4-hydroxyquinolin-2(1H)-one

출처 및 근거

ORD 기록
ord-e3c8594e36b441c58de6d305cf01a775
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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