R-BOCEPREVIR

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C27H45N5O5
Molecular Weight	519.6767
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(C)NC(=O)N[C@H](C(=O)N1C[C@H]2[C@@H]([C@H]1C(=O)N[C@H](CC3CCC3)C(=O)C(N)=O)C2(C)C)C(C)(C)C

InChI

InChIKey=LHHCSNFAOIFYRV-MUPNANLLSA-N

InChI=1S/C27H45N5O5/c1-25(2,3)20(30-24(37)31-26(4,5)6)23(36)32-13-15-17(27(15,7)8)18(32)22(35)29-16(19(33)21(28)34)12-14-10-9-11-14/h14-18,20H,9-13H2,1-8H3,(H2,28,34)(H,29,35)(H2,30,31,37)/t15-,16+,17-,18-,20+/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

R-BOCEPREVIR

Common Name

English

SCH534129

Common Name

English

SCH 534129

Common Name

English

BOCEPREVIR METABOLITE (SCH534129)

Common Name

English

(1S,4S,5R)-N-((1R)-3-AMINO-1-(CYCLOBUTYLMETHYL)-2,3-DIOXO-PROPYL)-3-((2S)-2-(TERT-BUTYLCARBAMOYLAMINO)-3,3-DIMETHYL-BUTANOYL)-6,6-DIMETHYL-3-AZABICYCLO(3.1.0)HEXANE-4-CARBOXAMIDE

Systematic Name

English

(1R,2S,5S)-N-((1R)-3-AMINO-1-(CYCLOBUTYLMETHYL)-2,3-DIOXOPROPYL)-3-((2S)-2-((((1,1-DIMETHYLETHYL)AMINO)CARBONYL)AMINO)-3,3-DIMETHYL-1-OXOBUTYL)-6,6-DIMETHYL-3-AZABICYCLO(3.1.0)HEXANE-2-CARBOXAMIDE

Systematic Name

English

Code System Code Type Description

PUBCHEM

15604474

Created by admin on Sat Dec 16 18:56:33 GMT 2023 , Edited by admin on Sat Dec 16 18:56:33 GMT 2023

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FDA UNII

D92PVZ9T6F

Created by admin on Sat Dec 16 18:56:33 GMT 2023 , Edited by admin on Sat Dec 16 18:56:33 GMT 2023

PRIMARY

CAS

569677-41-4

Created by admin on Sat Dec 16 18:56:33 GMT 2023 , Edited by admin on Sat Dec 16 18:56:33 GMT 2023

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SUBSTANCE RECORD


					D92PVZ9T6F

R-BOCEPREVIR