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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H31ClN4O3
Molecular Weight 495.013
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Pirmitegravir

SMILES

CN1C=C(CN2C(C)=C(C)C3=C(C4=CC=C(Cl)C=C4)C([C@H](OC(C)(C)C)C(O)=O)=C(C)N=C23)C=N1

InChI

InChIKey=GNRDGAWRAIJOSU-DEOSSOPVSA-N
InChI=1S/C27H31ClN4O3/c1-15-17(3)32(14-18-12-29-31(7)13-18)25-21(15)23(19-8-10-20(28)11-9-19)22(16(2)30-25)24(26(33)34)35-27(4,5)6/h8-13,24H,14H2,1-7H3,(H,33,34)/t24-/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Pirmitegravir
INN  
Official Name English
1H-Pyrrolo[2,3-b]pyridine-5-acetic acid, 4-(4-chlorophenyl)-α-(1,1-dimethylethoxy)-2,3,6-trimethyl-1-[(1-methyl-1H-pyrazol-4-yl)methyl]-, (αS)-
Systematic Name English
(αS)-4-(4-Chlorophenyl)-α-(1,1-dimethylethoxy)-2,3,6-trimethyl-1-[(1-methyl-1H-pyrazol-4-yl)methyl]-1H-pyrrolo[2,3-b]pyridine-5-acetic acid
Systematic Name English
pirmitegravir [INN]
Common Name English
Code System Code Type Description
FDA UNII
3XX9YW65ZA
Created by admin on Sat Dec 16 18:48:20 UTC 2023 , Edited by admin on Sat Dec 16 18:48:20 UTC 2023
PRIMARY
NCI_THESAURUS
C188509
Created by admin on Sat Dec 16 18:48:20 UTC 2023 , Edited by admin on Sat Dec 16 18:48:20 UTC 2023
PRIMARY
INN
11959
Created by admin on Sat Dec 16 18:48:20 UTC 2023 , Edited by admin on Sat Dec 16 18:48:20 UTC 2023
PRIMARY
CAS
2245231-10-9
Created by admin on Sat Dec 16 18:48:20 UTC 2023 , Edited by admin on Sat Dec 16 18:48:20 UTC 2023
PRIMARY
SMS_ID
300000044990
Created by admin on Sat Dec 16 18:48:20 UTC 2023 , Edited by admin on Sat Dec 16 18:48:20 UTC 2023
PRIMARY
PUBCHEM
142435949
Created by admin on Sat Dec 16 18:48:20 UTC 2023 , Edited by admin on Sat Dec 16 18:48:20 UTC 2023
PRIMARY