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Acetic Acid → 6-(1-methyl-1H-pyrazol-4-yl)-2-(3-(pyrrolidin-1-yl)azetidin-1-yl)benzo[d]thiazole

HRID 2155379
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HRID 2155379 반응식
[C:30]([O:31][BH-:32]([O:33][C:34](=[O:35])[CH3:36])[O:37][C:38](=[O:39])[CH3:40])(=[O:41])[CH3:42].[CH2:21]1[CH2:22][CH2:23][NH:24][CH2:25]1.[CH3:1][n:2]1[n:3][cH:4][c:5](-[c:7]2[cH:8][c:9]3[c:10]([n:11][c:12]([N:14]4[CH2:15][C:16](=[O:18])[CH2:17]4)[s:13]3)[cH:19][cH:20]2)[cH:6]1.[CH3:26][C:27](=[O:28])[OH:29].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[Na+:43]>>[CH3:1][n:2]1[n:3][cH:4][c:5](-[c:7]2[cH:8][c:9]3[c:10]([n:11][c:12]([N:14]4[CH2:15][CH:16]([N:24]5[CH2:23][CH2:22][CH2:21][CH2:25]5)[CH2:17]4)[s:13]3)[cH:19][cH:20]2)[cH:6]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 176Acetic AcidHCID 923Sodium IonHCID 1140TolueneHCID 31268PyrrolidineHCID 2724942TriacetoxyborohydrideHCID 669058091-(6-(1-methyl-1H-pyrazol-4-yl)benzo[d]thiazol-2-yl)azetidin-3-one

생성물 1

HCID 44124127
6-(1-methyl-1H-pyrazol-4-yl)-2-(3-(pyrrolidin-1-yl)azetidin-1-yl)benzo[d]thiazole

출처 및 근거

ORD 기록
ord-0b7ae26821b8428fb0a240cfa8397e32
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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