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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Methanol → {4-[(5-Chloro-thiophen-2-ylmethyl)-amino]-2,6-dimethyl-phenyl}-carbamic acid propyl ester

HRID 153678
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HRID 153678 반응식
[C:25]([BH3-:26])#[N:27].[CH2:1]([CH2:2][CH3:3])[O:4][C:5]([NH:6][c:7]1[c:8]([CH3:15])[cH:9][c:10]([NH2:14])[cH:11][c:12]1[CH3:13])=[O:16].[CH3:29][OH:30].[Cl:17][c:18]1[cH:19][cH:20][c:21]([CH:23]=[O:24])[s:22]1.[Na+:28]>>[CH2:1]([CH2:2][CH3:3])[O:4][C:5]([NH:6][c:7]1[c:8]([CH3:15])[cH:9][c:10]([NH:14][CH2:23][c:21]2[cH:20][cH:19][c:18]([Cl:17])[s:22]2)[cH:11][c:12]1[CH3:13])=[O:16]
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반응물 5

HCID 887MethanolHCID 923Sodium IonHCID 817002-Thiophenecarboxaldehyde, 5-chloro-HCID 498716Cyano-borohydrideHCID 68707091(4-Amino-2,6-dimethyl-phenyl)-carbamic acid propyl ester

생성물 1

HCID 11508619{4-[(5-Chloro-thiophen-2-ylmethyl)-amino]-2,6-dimethyl-phenyl}-carbamic acid propyl ester

출처 및 근거

ORD 기록
ord-64ffb310d26248cf907a9efd75b06c29
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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