Preferred Name |
sildenafil |
|
Synonyms |
5-{2-ethoxy-5-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one 1-((3-(4,7-Dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo(4,3-d)pyrimidin-5-yl)-4-ethoxyphenyl)sulfonyl)-4-methylpiperazine sildenafil |
|
Definitions |
A pyrazolo[4,3-d]pyrimidin-7-one having a methyl substituent at the 1-position, a propyl substituent at the 3-position and a 2-ethoxy-5-[(4-methylpiperazin-1-yl)sulfonyl]phenyl group at the 5-position. |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_9139 |
|
charge |
0 |
|
database_cross_reference |
LINCS:LSM-3797 KEGG:D08514 CAS:139755-83-2 Drug_Central:2441 DrugBank:DB00203 Patent:US5250534 Patent:EP463756 HMDB:HMDB0005039 Beilstein:7673458 KEGG:C07259 PDBeChem:VIA FooDB:FDB023606 Wikipedia:Sildenafil |
|
definition |
A pyrazolo[4,3-d]pyrimidin-7-one having a methyl substituent at the 1-position, a propyl substituent at the 3-position and a 2-ethoxy-5-[(4-methylpiperazin-1-yl)sulfonyl]phenyl group at the 5-position. |
|
formula |
C22H30N6O4S |
|
has role | ||
has_alternative_id |
CHEBI:46436 CHEBI:600437 |
|
has_exact_synonym |
5-{2-ethoxy-5-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}-1-methyl-3-propyl-1,6-dihydro-7H-pyrazolo[4,3-d]pyrimidin-7-one |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
1-((3-(4,7-Dihydro-1-methyl-7-oxo-3-propyl-1H-pyrazolo(4,3-d)pyrimidin-5-yl)-4-ethoxyphenyl)sulfonyl)-4-methylpiperazine sildenafil |
|
id |
CHEBI:9139 |
|
in_subset | ||
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) |
|
inchikey |
BNRNXUUZRGQAQC-UHFFFAOYSA-N |
|
label |
sildenafil |
|
mass |
474.57600 |
|
monoisotopicmass |
474.20492 |
|
notation |
CHEBI:9139 |
|
prefLabel |
sildenafil |
|
smiles |
CCCc1nn(C)c2c1nc([nH]c2=O)-c1cc(ccc1OCC)S(=O)(=O)N1CCN(C)CC1 |
|
treeView |
http://purl.obolibrary.org/obo/CHEBI_35358 |
|
subClassOf |
http://purl.obolibrary.org/obo/CHEBI_35358 |