N-Desmethyl sildenafil

Systematic / IUPAC Name: 5-[2-Ethoxy-5-(1-piperazinylsulfonyl)phenyl]-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one

ID: Reference820

Other Names: Demethylsildenafil

Formula: C21H28N6O4S

Class: Therapeutics/Prescription Drugs Drugs of Abuse/Illegal Drugs Counterfeit Drug (Therapeutic) Illegal Additives

Spectral Data

N-Desmethyl sildenafil mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 3
No. of Spectra 313
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 8/18/2016 12:42:47 PM
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Identificators

InChI InChI=1S/C21H28N6O4S/c1-4-6-16-18-19(26(3)25-16)21(28)24-20(23-18)15-13-14(7-8-17(15)31-5-2)32(29,30)27-11-9-22-10-12-27/h7-8,13,22H,4-6,9-12H2,1-3H3,(H,23,24,28)
InChI Key UZTKBZXHEOVDRL-UHFFFAOYSA-N
Canonical SMILES
CAS 139755821
Splash
Other Names Demethylsildenafil

In Other Databases

HMDb HMDB60932
ChEMBL CHEMBL910
PubChem 6426858
ChemSpider 4932278