SJ-3366

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H24N2O3
Molecular Weight	352.4269
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC1=C(N(CC2CC=CC2)C(=O)NC1=O)C(=O)C3=CC(C)=CC(C)=C3

InChI

InChIKey=BEMROAADXJFLBI-UHFFFAOYSA-N

InChI=1S/C21H24N2O3/c1-4-17-18(19(24)16-10-13(2)9-14(3)11-16)23(21(26)22-20(17)25)12-15-7-5-6-8-15/h5-6,9-11,15H,4,7-8,12H2,1-3H3,(H,22,25,26)

HIDE SMILES / InChI

Molecular Formula	C21H24N2O3
Molecular Weight	352.4269
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 20:57:48 GMT 2025` Edited by `admin` on `Mon Mar 31 20:57:48 GMT 2025`
Record UNII	WXZ5ZJ7HGJ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

SJ3366

Preferred Name

English

SJ-3366

Code

English

2,4(1H,3H)-PYRIMIDINEDIONE, 1-(3-CYCLOPENTEN-1-YLMETHYL)-6-(3,5-DIMETHYLBENZOYL)-5-ETHYL-

Systematic Name

English

IQP-0410

Common Name

English

IQP 0410

Common Name

English

1-(CYCLOPENT-3-ENYLMETHYL)-6-(3,5-DIMETHYLBENZOYL)-5-ETHYLPYRIMIDINE-2,4(1H,3H)-DIONE

Systematic Name

English

1-(3-CYCLOPENTEN-1-YLMETHYL)-6-(3,5-DIMETHYLBENZOYL)-5-ETHYL-2,4(1H,3H)-PYRIMIDINEDIONE

Systematic Name

English

Code System Code Type Description

FDA UNII

WXZ5ZJ7HGJ

Created by admin on Mon Mar 31 20:57:48 GMT 2025 , Edited by admin on Mon Mar 31 20:57:48 GMT 2025

PRIMARY

CAS

195720-26-4

Created by admin on Mon Mar 31 20:57:48 GMT 2025 , Edited by admin on Mon Mar 31 20:57:48 GMT 2025

PRIMARY

EPA CompTox

DTXSID50332984

Created by admin on Mon Mar 31 20:57:48 GMT 2025 , Edited by admin on Mon Mar 31 20:57:48 GMT 2025

PRIMARY

PUBCHEM

474597

Created by admin on Mon Mar 31 20:57:48 GMT 2025 , Edited by admin on Mon Mar 31 20:57:48 GMT 2025

PRIMARY

Related Record Type Details


					WXZ5ZJ7HGJ

SJ-3366

ACTIVE MOIETY

Comments:

We have identified and characterized a potent new nonnucleoside reverse transcriptase (RT) inhibitor (NNRTI) of human immunodeficiency virus type 1 (HIV-1) that also is active against HIV-2 and which interferes with virus replication by two distinct mechanisms. 1-(3-Cyclopenten-1-yl)methyl-6-(3,5-dimethylbenzoyl)-5-ethyl-2,4-pyrimidinedione (SJ-3366) inhibits HIV-1