C38H47N5O7S2
749.9 g/mol
APIWarning
Simeprevirum
CAS923604-59-5
Category
API
Compound Class
Amide
Primary Use
Pharmaceutical Raw Material
Simeprevirum is a chemical compound that functions as a hepatitis C virus protease inhibitor. It is utilized as an active pharmaceutical ingredient in the manufacturing of antiviral medications.
Pharmaceutical raw material for hepatitis C antiviral drugsResearch compound for virology studies
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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CAS 923604-59-5
Related Compounds
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Safety Reference
Warning
H302Harmful if swallowed
H319Causes serious eye irritation
H362May cause harm to breast-fed children
H410Very toxic to aquatic life with long lasting effects
H413May cause long lasting harmful effects to aquatic life
Identifiers
IUPAC Name
(1R,4R,6S,7Z,15R,17R)-N-cyclopropylsulfonyl-17-[7-methoxy-8-methyl-2-(4-propan-2-yl-1,3-thiazol-2-yl)quinolin-4-yl]oxy-13-methyl-2,14-dioxo-3,13-diazatricyclo[13.3.0.04,6]octadec-7-ene-4-carboxamide
InChIKey
JTZZSQYMACOLNN-VDWJNHBNSA-N
SMILES
CC1=C(C=CC2=C1N=C(C=C2O[C@@H]3C[C@@H]4[C@@H](C3)C(=O)N(CCCC/C=C\[C@@H]5C[C@]5(NC4=O)C(=O)NS(=O)(=O)C6CC6)C)C7=NC(=CS7)C(C)C)OC
Synonyms (22)
- HCV-PI
- 435, TMC
- 435350, TMC
- Olysio
- SIMEPREVIR SODIUM
- Simeprevir
- TMC-435, TMC-435350
- US8741926, 47
- US8754106, 47
- simeprevirum