7-(2-Butyn-1-yl)-3,7-dihydro-8-[(2-hydroxyethyl)amino]-3-methyl-1-[(4-methyl-2-quinazolinyl)methyl]-1H-purine-2,6-dione

Details

Stereochemistry	ACHIRAL
Molecular Formula	C22H23N7O3
Molecular Weight	433.4631
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-(2-Butyn-1-yl)-3,7-dihydro-8-[(2-hydroxyethyl)amino]-3-methyl-1-[(4-methyl-2-quinazolinyl)methyl]-1H-purine-2,6-dione

Structure Search

SMILES

CC#CCN1C(NCCO)=NC2=C1C(=O)N(CC3=NC4=C(C=CC=C4)C(C)=N3)C(=O)N2C

InChI

InChIKey=YORIADKXXGJPET-UHFFFAOYSA-N

InChI=1S/C22H23N7O3/c1-4-5-11-28-18-19(26-21(28)23-10-12-30)27(3)22(32)29(20(18)31)13-17-24-14(2)15-8-6-7-9-16(15)25-17/h6-9,30H,10-13H2,1-3H3,(H,23,26)

HIDE SMILES / InChI

Molecular Formula	C22H23N7O3
Molecular Weight	433.4631
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 `Wed Apr 02 19:35:30 GMT 2025` Edited by `admin` on `Wed Apr 02 19:35:30 GMT 2025`
Record UNII	DS6LBW9NNM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1H-Purine-2,6-dione, 7-(2-butyn-1-yl)-3,7-dihydro-8-[(2-hydroxyethyl)amino]-3-methyl-1-[(4-methyl-2-quinazolinyl)methyl]-

Preferred Name

English

7-(2-Butyn-1-yl)-3,7-dihydro-8-[(2-hydroxyethyl)amino]-3-methyl-1-[(4-methyl-2-quinazolinyl)methyl]-1H-purine-2,6-dione

Systematic Name

English

Code System Code Type Description

FDA UNII

DS6LBW9NNM

Created by admin on Wed Apr 02 19:35:30 GMT 2025 , Edited by admin on Wed Apr 02 19:35:30 GMT 2025

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PUBCHEM

78358436

Created by admin on Wed Apr 02 19:35:30 GMT 2025 , Edited by admin on Wed Apr 02 19:35:30 GMT 2025

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CAS

2074688-84-7

Created by admin on Wed Apr 02 19:35:31 GMT 2025 , Edited by admin on Wed Apr 02 19:35:31 GMT 2025

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