| SpectraBase Spectrum ID |
DkV5JIG4OmW |
| Name |
Thiosildenafil |
| Classification |
Pharmaceutical drug, vasodilator |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
490.182081195 u |
| Formula |
C22H30N6O3S2 |
| InChI |
InChI=1S/C22H30N6O3S2/c1-5-7-17-19-20(27(4)25-17)22(32)24-21(23-19)16-14-15(8-9-18(16)31-6-2)33(29,30)28-12-10-26(3)11-13-28/h8-9,14H,5-7,10-13H2,1-4H3,(H,23,24,32) |
| InChIKey |
LJUBVCQVNMLSTQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
490.641 g/mol |
| Nominal Mass |
490 u |
| Quality |
934 |
| Retention Index |
3935 |
| SMILES |
C12=C(N=C(C=3C(=CC=C(S(N4CCN(CC4)C)(=O)=O)C3)OCC)NC1=S)C(=NN2C)CCC |
| SPLASH |
splash10-0002-9233400000-71432874216af3dbb1f9 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-(2-ethoxy-5-((4-methylpiperazin-1-yl)sulfonyl)phenyl)-1-methyl-3-propyl-1,6-dihydro-7H-\rpyrazolo[4,3-d]pyrimidine-7-thione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_027347 |
