Primary record
(8S)-N-((1S)-1-cyano-2-((3S)-2-oxopyrrolidin-3-yl)ethyl)-7-((2R)-3,3-dimethyl-2-(2,2,2-trifluoroacetamido)butanoyl)-1,4-dithia-7-azaspiro(4.4)nonane-8-carboxamide
- 库存
- 7,675 克
- 纯度
- 99.6 %
- CAS
- 2920904-06-7
化合物标识与属性
- CAS
- 2920904-06-7
- PubChem CID
- 167312484
- SMILES
- COC[C@H](C(=O)N[C@H](CC1=CC=CC=C1)C(=O)C(=O)NCC2=NC=CS2)NC(=O)C3CCCC(C3)(F)F
- Canonical SMILES
- COC[C@@H](NC(=O)C1CCCC(F)(F)C1)C(=O)N[C@H](Cc1ccccc1)C(=O)C(=O)NCc1nccs1
名称与同义词
- simnotrelvir
- SY110
- R4QFU2UR3K
- Simnotrelvir [WHO-DD]
- RefChem:931758
- SIM0417
- SSD8432
- SY-110
- SIM-0417
- SSD-8432
- SARS-CoV-2-IN-41
- CHEMBL5570561
- SCHEMBL29096454
- GTPL12654
- GLXC-27094
- SIM 0417
- Simnotrelvir component of xiannuoxin
- SSD 8432
- XIANNUOXIN COMPONENT SIMNOTRELVIR
- SARS-CoV-2 Mpro inhibitor SY110
- compound 3w [PMID: 36928316]
- N-((R)-1-(((R)-3,4-dioxo-1-phenyl-4-((thiazol-2-ylmethyl)amino)butan-2-yl)amino)-3-methoxy-1-oxopropan-2-yl)-3,3-difluorocyclohexane-1-carboxamide
- (8S)-N-((1S)-1-cyano-2-((3S)-2-oxopyrrolidin-3-yl)ethyl)-7-((2R)-3,3-dimethyl-2-(2,2,2-trifluoroacetamido)butanoyl)-1,4-dithia-7-azaspiro(4.4)nonane-8-carboxamide
- 2920904-06-7
- N-((2R)-1-(((2R)-3,4-dioxo-1-phenyl-4-(1,3-thiazol-2-ylmethylamino)butan-2-yl)amino)-3-methoxy-1-oxopropan-2-yl)-3,3-difluorocyclohexane-1-carboxamide
- N-[(1R)-2-[[(1R)-1-benzyl-2,3-dioxo-3-(thiazol-2-ylmethylamino)propyl]amino]-1-(methoxymethyl)-2-oxo-ethyl]-3,3-difluorocyclohexanecarboxamide
- N-[(2R)-1-[[(2R)-3,4-dioxo-1-phenyl-4-(1,3-thiazol-2-ylmethylamino)butan-2-yl]amino]-3-methoxy-1-oxopropan-2-yl]-3,3-difluorocyclohexane-1-carboxamide