Sodium ion → HCID 67141111, 화합물

HRID 117068노트

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HRID 117068 반응식
[CH:34]([CH3:35])([CH3:36])[N:37]=[C:38]=[O:39].[Cl:1][c:2]1[c:3]([S:8](=[O:9])(=[O:10])[N:11]2[CH:12]([C:14](=[O:15])[N:16]3[CH2:17][CH2:18][N:19]([c:22]4[n:23][cH:24][cH:25][cH:26][c:27]4[C:28]([F:29])([F:30])[F:31])[CH2:20][CH2:21]3)[CH2:13]2)[cH:4][cH:5][cH:6][cH:7]1.[I-:33].[Na+:32]>>[Cl:1][c:2]1[c:3]([S:8](=[O:9])(=[O:10])[N:11]2[CH2:13][CH:12]([C:14](=[O:15])[N:16]3[CH2:17][CH2:18][N:19]([c:22]4[n:23][cH:24][cH:25][cH:26][c:27]4[C:28]([F:29])([F:30])[F:31])[CH2:20][CH2:21]3)[N:37]([CH:34]([CH3:35])[CH3:36])[C:38]2=[O:39])[cH:4][cH:5][cH:6][cH:7]1

참가 물질

5

반응물 4

HCID 923Sodium ionHCID 30165Iodide IonHCID 61277Isopropyl isocyanateHCID 86623485[(S)-1-(2-chloro-benzenesulfonyl)-aziridin-2-yl]-[4-(3-trifluoromethyl-pyridin-2-yl)-piperazin-1-yl]-methanone

생성물 1

HCID 67141111HCID 67141111, 화합물

출처 및 근거

ORD 기록
ord-27d9d7d38c5942b8b348545ff475824a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

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