Sildenafil

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

ID: Reference950

Other Names: Aphrodil;
Caverta;
Revatio;
1-{[3-(4,7-Dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxyphenyl]sulfonyl}-4-methylpiperazine ;
Piperazine, 1-{[3-(4,7-dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxyphenyl]sulfonyl}-4-methyl-

Formula: C22H30N6O4S

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

Spectral Data

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 7
No. of Spectra 711
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/3/2016 9:52:35 AM
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Identificators

InChI InChI=1S/C22H30N6O4S/c1-5-7-17-19-20(27(4)25-17)22(29)24-21(23-19)16-14-15(8-9-18(16)32-6-2)33(30,31)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,29)
InChI Key BNRNXUUZRGQAQC-UHFFFAOYSA-N
Canonical SMILES CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)C)OCC)C
CAS 139755832
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Other Names Aphrodil;
Caverta;
Revatio;
1-{[3-(4,7-Dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxyphenyl]sulfonyl}-4-methylpiperazine ;
Piperazine, 1-{[3-(4,7-dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-ethoxyphenyl]sulfonyl}-4-methyl-

In Other Databases

DrugBank APRD00556
ChemSpider 5023
HMDb HMDB05039
Wikipedia Sildenafil
ChEBI CHEBI:9139
PubChem 5212
KEGG C07259; D08514
ChemIDPlus 139755832
ChEMBL CHEMBL192