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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Ammonium → Carbamic acid, N-[4-chloro-5-[[5-chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]hydroxymethyl]-2-thiazolyl]-, 1,1-dimethylethyl ester

HRID 107743
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HRID 107743 반응식
[C:26]([CH3:27])([CH3:28])([CH3:29])[O:30][C:31]([NH:32][c:33]1[s:34][c:35]([CH:39]=[O:40])[c:36]([Cl:38])[n:37]1)=[O:41].[CH:22]([Mg+:23])([CH3:24])[CH3:25].[Cl-:21].[Cl-:42].[NH4+:43].[O:44]1[CH2:45][CH2:46][CH2:47][CH2:48]1.[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][c:12]([I:20])[c:13]3[c:14]2[n:15][cH:16][c:17]([Cl:19])[cH:18]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([S:7](=[O:8])(=[O:9])[n:10]2[cH:11][c:12]([CH:39]([c:35]3[s:34][c:33]([NH:32][C:31]([O:30][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:41])[n:37][c:36]3[Cl:38])[OH:40])[c:13]3[c:14]2[n:15][cH:16][c:17]([Cl:19])[cH:18]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1
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참가 물질

7

반응물 6

HCID 223AmmoniumHCID 312Chloride2회HCID 8028TetrahydrofuranHCID 242292391-Benzenesulfonyl-5-chloro-3-iodo-1H-pyrrolo[2,3-b]pyridineHCID 45117878Tert-butyl (4-chloro-5-formylthiazol-2-yl)carbamateHCID 178461726HCID 178461726, 화합물

생성물 1

HCID 57619425
Carbamic acid, N-[4-chloro-5-[[5-chloro-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]hydroxymethyl]-2-thiazolyl]-, 1,1-dimethylethyl ester

출처 및 근거

ORD 기록
ord-de17611924854e6ea26a8fa8636214f0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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