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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H37N3O7S
Molecular Weight 547.664
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DARUNAVIR, (1R)-

SMILES

CC(C)CN(C[C@@H](O)[C@@H](CC1=CC=CC=C1)NC(=O)O[C@H]2CO[C@H]3OCC[C@@H]23)S(=O)(=O)C4=CC=C(N)C=C4

InChI

InChIKey=CJBJHOAVZSMMDJ-FMTGGWRCSA-N
InChI=1S/C27H37N3O7S/c1-18(2)15-30(38(33,34)21-10-8-20(28)9-11-21)16-24(31)23(14-19-6-4-3-5-7-19)29-27(32)37-25-17-36-26-22(25)12-13-35-26/h3-11,18,22-26,31H,12-17,28H2,1-2H3,(H,29,32)/t22-,23+,24+,25-,26+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
(3R,3AS,6AR)-HEXAHYDROFURO(2,3-B)FURAN-3-YL ((2R,3R)-4-((4-AMINO-N-ISOBUTYLPHENYL)SULFONAMIDO)-3-HYDROXY-1-PHENYLBUTAN-2-YL)CARBAMATE
Preferred Name English
DARUNAVIR, (1R)-
Common Name English
CARBAMIC ACID, N-((1R,2R)-3-(((4-AMINOPHENYL)SULFONYL)(2-METHYLPROPYL)AMINO)-2-HYDROXY-1-(PHENYLMETHYL)PROPYL)-, (3R,3AS,6AR)-HEXAHYDROFURO(2,3-B)FURAN-3-YL ESTER
Systematic Name English
Code System Code Type Description
PUBCHEM
131667685
Created by admin on Wed Apr 02 07:43:32 GMT 2025 , Edited by admin on Wed Apr 02 07:43:32 GMT 2025
PRIMARY
CAS
1546918-95-9
Created by admin on Wed Apr 02 07:43:32 GMT 2025 , Edited by admin on Wed Apr 02 07:43:32 GMT 2025
PRIMARY
FDA UNII
UX4G61Z45Q
Created by admin on Wed Apr 02 07:43:32 GMT 2025 , Edited by admin on Wed Apr 02 07:43:32 GMT 2025
PRIMARY