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Substance Name: Elbasvir [USAN:INN]
RN: 1370468-36-2
UNII: 632L571YDK
InChIKey: BVAZQCUMNICBAQ-PZHYSIFUSA-N

Note

  • Inhibits NS5A protein of hepatitis C virus.

Classification Codes

  • Antiviral
  • Treatment of Hepatis C

Molecular Formula

  • C49-H55-N9-O7

Molecular Weight

  • 882.0295
 
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Names and Synonyms

Name of Substance

  • Elbasvir [USAN:INN]

Synonyms

  • Dimethyl N,N'-(((6S)-6-phenylindolo(1,2-c)(1,3)benzoxazine-3,10-diyl)bis(1H-imidazole-5,2-diyl-(2S)-pyrrolidine-2,1-diyl((2S)-3-methyl-1-oxobutane-1,2-diyl)))dicarbamate
  • Elbasvir
  • Methyl ((1S)-1-(((2S)-2-(4-((6S)-10-(2-((2S)-1-((2S)-2-((methoxycarbonyl)amino)-3-methylbutanoyl)pyrrolidin-2-yl)-1H-imidazol-4-yl)-6-phenyl-6H-indolo(1,2-c)(1,3)benzoxazin-3-yl)-1H-imidazol-2-yl)pyrrolidin-1-yl)carbonyl)-2-methylpropyl)carbamate
  • MK 8742
  • MK-8742
  • MK8742
  • UNII-632L571YDK

Systematic Name

  • Carbamic acid, N,N'-(((6S)-6-phenyl-6H-indolo(1,2-c)(1,3)benzoxazine-3,10-diyl)bis(1H-imidazole-5,2-diyl-(2S)-2,1-pyrrolidinediyl((1S)-1-(1-methylethyl)-2-oxo-2,1-ethanediyl)))bis-, C,C'-dimethyl ester

Registry Numbers

CAS Registry Number

  • 1370468-36-2

FDA UNII

  • 632L571YDK

Other Registry Number

  • 1444832-51-2

System Generated Number

  • 1370468362

Structure Descriptors

InChI

1S/C49H55N9O7/c1-27(2)41(54-48(61)63-5)45(59)56-20-10-14-37(56)43-50-25-34(52-43)30-17-19-36-32(22-30)23-39-33-18-16-31(24-40(33)65-47(58(36)39)29-12-8-7-9-13-29)35-26-51-44(53-35)38-15-11-21-57(38)46(60)42(28(3)4)55-49(62)64-6/h7-9,12-13,16-19,22-28,37-38,41-42,47H,10-11,14-15,20-21H2,1-6H3,(H,50,52)(H,51,53)(H,54,61)(H,55,62)/t37-,38-,41-,42-,47-/m0/s1

InChIKey

BVAZQCUMNICBAQ-PZHYSIFUSA-N

Smiles

COC(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1c2ncc([nH]2)c3ccc4c(O[C@@H](c5ccccc5)n6c4cc7cc(ccc67)c8cnc([nH]8)[C@@H]9CCCN9C(=O)[C@@H](NC(=O)OC)C(C)C)c3