SpectraBase Spectrum ID |
JEgHibOINFo |
Name |
Methisosildenafil |
Classification |
Phospordiesterase-Typ5-Inhibitor |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
488.220574704 u |
Formula |
C23H32N6O4S |
InChI |
InChI=1S/C23H32N6O4S/c1-6-8-18-20-21(28(5)27-18)23(30)26-22(25-20)17-11-16(9-10-19(17)33-7-2)34(31,32)29-12-14(3)24-15(4)13-29/h9-11,14-15,24H,6-8,12-13H2,1-5H3,(H,25,26,30) |
InChIKey |
NFSWSZIPXJAYLR-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
488.607 g/mol |
Nominal Mass |
488 u |
Quality |
995 |
Retention Index |
4042 |
SMILES |
C=1(C2=CC(S(N3CC(NC(C3)C)C)(=O)=O)=CC=C2OCC)NC(C2=C(C(=NN2C)CCC)N1)=O |
SPLASH |
splash10-03di-5920000000-8b4698e37a5002925955 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
5-(5-((3,5-dimethylpiperazin-1-yl)sulfonyl)-2-ethoxyphenyl)-1-methyl-3-propyl-1,6-dihydro-7H-\rpyrazolo[4,3-d]pyrimidin-7-one |
Technique |
GC/MS |
Wiley ID |
DD2024_009932 |