Zepatier
(1R,18R,20R,24S,27S)-24-tert-butyl-N-[(1R,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-7-methoxy-22,25-dioxo-2,21-dioxa-4,11,23,26-tetrazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3,5(10),6,8,11-pentaene-27-carboxamide;methyl N-[(2S)-1-[(2R)-2-[4-[(6S)-10-[2-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]-6-phenyl-6H-indolo[1,2-c][1,3]benzoxazin-3-yl]-2H-imidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
Molecular Identity
Zepatier
(1R,18R,20R,24S,27S)-24-tert-butyl-N-[(1R,2S)-1-(cyclopropylsulfonylcarbamoyl)-2-ethenylcyclopropyl]-7-methoxy-22,25-dioxo-2,21-dioxa-4,11,23,26-tetrazapentacyclo[24.2.1.03,12.05,10.018,20]nonacosa-3,5(10),6,8,11-pentaene-27-carboxamide;methyl N-[(2S)-1-[(2R)-2-[4-[(6S)-10-[2-[(2S)-1-[(2S)-2-(methoxycarbonylamino)-3-methylbutanoyl]pyrrolidin-2-yl]-1H-imidazol-5-yl]-6-phenyl-6H-indolo[1,2-c][1,3]benzoxazin-3-yl]-2H-imidazol-2-yl]pyrrolidin-1-yl]-3-methyl-1-oxobutan-2-yl]carbamate
PubChem CID: 91669168
2D Structure
Properties
C87H105N15O16S
Molecular Formula
1648.90
Molecular Weight
g/mol
1647.7584
Exact Mass
Da
388
TPSA
May have limited oral absorption
6
H-Bond Donors
21
H-Bond Acceptors
3370
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(17)
ZepatierElbasvir / grazoprevirElbasvir and grazoprevirZepatier (TN)Elbasvir-GrazoprevirGrazoprevir-ElbasvirGrazoprevir/ElbasvirElbasvir-grazoprevir mixtRefChem:904855ELBASVIR/GRAZOPREVIRELBASVIR; GRAZOPREVIRCHEBI:132973MK-8742/ MK-5172elbasvir & grazoprevirelbasvir + grazoprevir
Data from PubChem (NCBI)
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