Benzyl sildenafil

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

ID: Reference762

Other Names: N-Desmethyl-N-benzyl sildenafil;
7H-Pyrazolo[4,3-d]pyrimidin-7-one, 5-(2-ethoxy-5-{[4-(phenylmethyl)-1-piperazinyl]sulfonyl}phenyl)-1,6-dihydro-1-methyl-3-propyl-

Formula: C28H34N6O4S

Class: Counterfeit Drug (Therapeutic) Illegal Additives

Spectral Data

Benzyl 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 2
No. of Spectra 194
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/12/2016 11:10:03 AM
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Identificators

InChI InChI=1S/C28H34N6O4S/c1-4-9-23-25-26(32(3)31-23)28(35)30-27(29-25)22-18-21(12-13-24(22)38-5-2)39(36,37)34-16-14-33(15-17-34)19-20-10-7-6-8-11-20/h6-8,10-13,18H,4-5,9,14-17,19H2,1-3H3,(H,29,30,35)
InChI Key ZNBBYJQSWODKSY-UHFFFAOYSA-N
Canonical SMILES CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CC5=CC=CC=C5)OCC)C
CAS
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Other Names N-Desmethyl-N-benzyl sildenafil;
7H-Pyrazolo[4,3-d]pyrimidin-7-one, 5-(2-ethoxy-5-{[4-(phenylmethyl)-1-piperazinyl]sulfonyl}phenyl)-1,6-dihydro-1-methyl-3-propyl-

In Other Databases

PubChem 109374011
ChemSpider 48058511