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Chloroform → (+)-N-(7-[1,4]Dioxan-2-yl-4-methoxy-benzothiazol-2-yl)-2-methoxy-acetamide

HRID 181438
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HRID 181438 반응식
[CH2:31]([N:32]([CH:33]([CH3:34])[CH3:35])[CH:36]([CH3:37])[CH3:38])[CH3:39].[CH2:58]1[O:59][CH2:60][CH2:61][CH2:62]1.[CH3:1][O:2][CH2:3][C:4](=[O:5])[OH:6].[Cl:63][CH:64]([Cl:65])[Cl:66].[O:40]1[CH:41]([c:46]2[cH:47][cH:48][c:49]([O:56][CH3:57])[c:50]3[n:51][c:52]([NH2:55])[s:53][c:54]23)[CH2:42][O:43][CH2:44][CH2:45]1.[P-:7]([F:8])([F:9])([F:10])([F:11])([F:12])[F:13].[n:14]1([O:15][C:16]([N:17]([CH3:18])[CH3:19])=[N+:20]([CH3:21])[CH3:22])[c:23]2[n:24][cH:25][cH:26][cH:27][c:28]2[n:29][n:30]1>>[CH3:1][O:2][CH2:3][C:4](=[O:6])[NH:55][c:52]1[n:51][c:50]2[c:49]([O:56][CH3:57])[cH:48][cH:47][c:46]([CH:41]3[O:40][CH2:45][CH2:44][O:43][CH2:42]3)[c:54]2[s:53]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 6212ChloroformHCID 8028TetrahydrofuranHCID 9886HexafluorophosphateHCID 12251Methoxyacetic AcidHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 22507697
(+)-7-[1,4)Dioxan-2-yl-4-methoxy-benzothiazol-2-ylamine

생성물 1

HCID 22507688(+)-N-(7-[1,4]Dioxan-2-yl-4-methoxy-benzothiazol-2-yl)-2-methoxy-acetamide

출처 및 근거

ORD 기록
ord-5c64498af33c4227a603aae063536e98
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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