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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Acetonitrile → [1-[[5-tert-butyl-2-[C-(5-chloro-2-methoxyphenyl)-N-cyanocarbonimidoyl]imino-1,3-thiazol-3-yl]methyl]cyclohexyl] acetate

HRID 318251
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인쇄 미리보기

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HRID 318251 반응식
[C:1]([CH3:2])(=[O:3])[O:4][C:5]1([CH2:11][n:12]2[c:13](=[N:21][C:22](=[S:23])[c:24]3[c:25]([O:31][CH3:32])[cH:26][cH:27][c:28]([Cl:30])[cH:29]3)[s:14][c:15]([C:17]([CH3:18])([CH3:19])[CH3:20])[cH:16]2)[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1.[CH3:33][CH2:34][N:35]([CH2:36][CH3:37])[CH2:38][CH3:39].[CH3:43][C:44]#[N:45].[NH2:40][C:41]#[N:42]>>[C:1]([CH3:2])(=[O:3])[O:4][C:5]1([CH2:11][n:12]2[c:13](=[N:21][C:22]([c:24]3[c:25]([O:31][CH3:32])[cH:26][cH:27][c:28]([Cl:30])[cH:29]3)=[N:42][C:41]#[N:40])[s:14][c:15]([C:17]([CH3:18])([CH3:19])[CH3:20])[cH:16]2)[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1
참가 물질출처 및 근거반응 노트

참가 물질

5

반응물 4

HCID 6342AcetonitrileHCID 8471TriethylamineHCID 9864CyanamideHCID 87179552[1-[[5-Tert-butyl-2-(5-chloro-2-methoxybenzenecarbothioyl)imino-1,3-thiazol-3-yl]methyl]cyclohexyl] acetate

생성물 1

HCID 87179357[1-[[5-tert-butyl-2-[C-(5-chloro-2-methoxyphenyl)-N-cyanocarbonimidoyl]imino-1,3-thiazol-3-yl]methyl]cyclohexyl] acetate

출처 및 근거

ORD 기록
ord-778904d6d3c34a03ae93d5757be103eb
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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