Telaprevir
CAS Registry Number®
402957-28-2
CAS Name
TelaprevirMolecular Formula
C36H53N7O6Molecular Mass
679.85Cite this Page
Telaprevir. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=402957-28-2 (retrieved ) (CAS RN: 402957-28-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C36H53N7O6/c1-5-10-25(29(44)34(48)39-23-15-16-23)40-33(47)28-24-14-9-13-22(24)20-43(28)35(49)30(36(2,3)4)42-32(46)27(21-11-7-6-8-12-21)41-31(45)26-19-37-17-18-38-26/h17-19,21-25,27-28,30H,5-16,20H2,1-4H3,(H,39,48)(H,40,47)(H,41,45)(H,42,46)/t22-,24-,25-,27-,28-,30+/m0/s1
InChIKey
InChIKey=BBAWEDCPNXPBQM-GDEBMMAJSA-N
SMILES
C(N[C@H](C(C(NC1CC1)=O)=O)CCC)(=O)[C@@H]2[C@@]3([C@](CN2C([C@@H](NC([C@@H](NC(=O)C=4C=NC=CN4)C5CCCCC5)=O)C(C)(C)C)=O)(CCC3)[H])[H]
Canonical SMILES
O=C(NC1CC1)C(=O)C(NC(=O)C2N(C(=O)C(NC(=O)C(NC(=O)C3=NC=CN=C3)C4CCCCC4)C(C)(C)C)CC5CCCC25)CCC
Other Names for this Substance
- Cyclopenta[c]pyrrole-1-carboxamide, (2S)-2-cyclohexyl-N-(2-pyrazinylcarbonyl)glycyl-3-methyl-L-valyl-N-[(1S)-1-[2-(cyclopropylamino)-2-oxoacetyl]butyl]octahydro-, (1S,3aR,6aS)-
- Cyclopenta[c]pyrrole-1-carboxamide, (2S)-2-cyclohexyl-N-(pyrazinylcarbonyl)glycyl-3-methyl-L-valyl-N-[(1S)-1-[(cyclopropylamino)oxoacetyl]butyl]octahydro-, (1S,3aR,6aS)-
- (1S,3aR,6aS)-(2S)-2-Cyclohexyl-N-(2-pyrazinylcarbonyl)glycyl-3-methyl-L-valyl-N-[(1S)-1-[2-(cyclopropylamino)-2-oxoacetyl]butyl]octahydrocyclopenta[c]pyrrole-1-carboxamide
- VX 950
- LY 570310
Deleted or Replaced CAS Registry Numbers
569364-34-7