Hydrochloric Acid → 5-(7-Methoxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-4-yl)-4,4-dimethyl-2-[1-(naphthalen-2-ylsulfonyl)piperidin-4-yl]-2,4-dihydro-3H-pyrazol-3-one

HRID 665351

반응식

HRID 665351 반응식
[CH3:2][O:3][c:4]1[cH:5][cH:6][c:7]([C:15]2=[N:19][N:18]([CH:20]3[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]3)[C:17](=[O:26])[C:16]2([CH3:27])[CH3:28])[c:8]2[c:12]1[O:11][C:10]([CH3:13])([CH3:14])[CH2:9]2.[ClH:1].[cH:29]1[c:30]([S:39](=[O:40])(=[O:41])[Cl:42])[cH:31][cH:32][c:33]2[cH:34][cH:35][cH:36][cH:37][c:38]12>>[CH3:2][O:3][c:4]1[cH:5][cH:6][c:7]([C:15]2=[N:19][N:18]([CH:20]3[CH2:21][CH2:22][N:23]([S:39]([c:30]4[cH:29][c:38]5[c:33]([cH:32][cH:31]4)[cH:34][cH:35][cH:36][cH:37]5)(=[O:40])=[O:41])[CH2:24][CH2:25]3)[C:17](=[O:26])[C:16]2([CH3:27])[CH3:28])[c:8]2[c:12]1[O:11][C:10]([CH3:13])([CH3:14])[CH2:9]2

참가 물질

4

반응물 3

HCID 313Hydrochloric AcidHCID 71252-Naphthalenesulfonyl chlorideHCID 666165915-(7-Methoxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-4-yl)-4,4-dimethyl-2-piperidin-4-yl-2,4-dihydro-3H-pyrazol-3-one

생성물 1

HCID 462036785-(7-Methoxy-2,2-dimethyl-2,3-dihydro-1-benzofuran-4-yl)-4,4-dimethyl-2-[1-(naphthalen-2-ylsulfonyl)piperidin-4-yl]-2,4-dihydro-3H-pyrazol-3-one

출처 및 근거

ORD 기록
ord-1e12da58b83f4f54ae43d7d5bf8d2bcf
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

연결된 노트

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