Pirmitegravir

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 Search

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

Molecular Formula	C27H31ClN4O3
Molecular Weight	495.013
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 12:18:51 GMT 2025` Edited by `admin` on `Wed Apr 02 12:18:51 GMT 2025`
Record UNII	3XX9YW65ZA
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Pirmitegravir

Official Name

English

pirmitegravir [INN]

Preferred Name

English

1H-Pyrrolo[2,3-b]pyridine-5-acetic acid, 4-(4-chlorophenyl)-?-(1,1-dimethylethoxy)-2,3,6-trimethyl-1-[(1-methyl-1H-pyrazol-4-yl)methyl]-, (?S)-

Systematic Name

English

(?S)-4-(4-Chlorophenyl)-?-(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

Code System Code Type Description

FDA UNII

3XX9YW65ZA