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Substance Name: Cobicistat [USAN:INN]
RN: 1004316-88-4
UNII: LW2E03M5PG
InChIKey: ZCIGNRJZKPOIKD-CQXVEOKZSA-N

Note

  • A carbamate and thiazole derivative that functions as a CYTOCHROME P450 CYP3A INHIBITOR to enhance the concentration of ANTI-HIV AGENTS, with which it is used in combination, for the treatment of HIV INFECTIONS.

Molecular Formula

  • C40-H53-N7-O5-S2

Molecular Weight

  • 776.0347
 

Classification Codes

  • Anti-HIV Agents
  • Anti-Infective Agents
  • Anti-Retroviral Agents
  • Antiviral Agents
  • Cytochrome P-450 CYP3A Inhibitors
  • Cytochrome P-450 Enzyme Inhibitors
  • Enzyme Inhibitors
  • Metabolic Side Effects of Drugs and Substances
  • Treatment of HIV-1 Infection

Names and Synonyms

Name of Substance

  • Cobicistat
  • Cobicistat [USAN:INN]

MeSH Heading

  • Cobicistat

Synonyms

  • Cobicistat
  • GS 9350
  • GS-9350
  • Tybost
  • UNII-LW2E03M5PG

Systematic Names

  • 2,7,10,12-Tetraazatridecanoic acid, 12-methyl-13-(2-(1-methylethyl)-4-thiazolyl)-9-(2-(4-morpholinyl)ethyl)-8,11-dioxo-3,6-bis(phenylmethyl)-, 5-thiazolylmethyl ester, (3R,6R,9S)-
  • Thiazol-5-ylmethyl ((1R,4R)-1-benzyl-4-({(2S)-2-((methyl{(2-(1-methylethyl)thiazol-4-yl)methyl}carbamoyl)amino)-4-(morpholin-4-yl)butanoyl}amino)-5-phenylpentyl)carbamate

Registry Numbers

CAS Registry Number

  • 1004316-88-4

FDA UNII

  • LW2E03M5PG

System Generated Number

  • 1004316884

Structure Descriptors

InChI

1S/C40H53N7O5S2/c1-29(2)38-43-34(27-53-38)25-46(3)39(49)45-36(16-17-47-18-20-51-21-19-47)37(48)42-32(22-30-10-6-4-7-11-30)14-15-33(23-31-12-8-5-9-13-31)44-40(50)52-26-35-24-41-28-54-35/h4-13,24,27-29,32-33,36H,14-23,25-26H2,1-3H3,(H,42,48)(H,44,50)(H,45,49)/t32-,33-,36+/m1/s1

InChIKey

ZCIGNRJZKPOIKD-CQXVEOKZSA-N

Smiles

C(=O)(N[C@H](CC[C@@H](NC(=O)[C@@H](NC(=O)N(Cc1nc(sc1)C(C)C)C)CCN1CCOCC1)Cc1ccccc1)Cc1ccccc1)OCc1scnc1