loading...| Preferred Name |
avanafil |
|
| Synonyms |
4-[(3-chloro-4-methoxybenzyl)amino]-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide (S)-4-(3-Chloro-4-methoxybenzylamino)-2-(2-hydroxymethylpyrrolidin-1-yl)-N-pyrimidin-2-ylmethyl-5-pyrimidinecarboxamide Stendra avanafil |
|
| Definitions |
A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 4-[(3-chloro-4-methoxybenzyl)amino]-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]pyrimidine-5-carboxylic acid with the amino group of pyrimidin-2-ylmethylamine. Used for treatment of erectile dysfunction. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_66876 |
|
| charge |
0 |
|
| database_cross_reference |
PMID:22759639 PMID:20939743 PMID:21905762 Patent:US6403597 PMID:22788525 CAS:330784-47-9 PMID:22248153 Patent:EP1366760 PMID:22448738 PMID:22384456 PMID:22087063 PMID:18491987 PMID:21745238 PMID:20637970 Wikipedia:Avanafil Drug_Central:4305 KEGG:D03217 PMID:18197727 Reaxys:11746013 PMID:22704456 |
|
| definition |
A monocarboxylic acid amide obtained by formal condensation of the carboxy group of 4-[(3-chloro-4-methoxybenzyl)amino]-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]pyrimidine-5-carboxylic acid with the amino group of pyrimidin-2-ylmethylamine. Used for treatment of erectile dysfunction. |
|
| formula |
C23H26ClN7O3 |
|
| has role | ||
| has_exact_synonym |
4-[(3-chloro-4-methoxybenzyl)amino]-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
(S)-4-(3-Chloro-4-methoxybenzylamino)-2-(2-hydroxymethylpyrrolidin-1-yl)-N-pyrimidin-2-ylmethyl-5-pyrimidinecarboxamide Stendra avanafil |
|
| has_RxCUI |
1291301 |
|
| id |
CHEBI:66876 |
|
| in_subset | ||
| inchi |
InChI=1S/C23H26ClN7O3/c1-34-19-6-5-15(10-18(19)24)11-27-21-17(22(33)28-13-20-25-7-3-8-26-20)12-29-23(30-21)31-9-2-4-16(31)14-32/h3,5-8,10,12,16,32H,2,4,9,11,13-14H2,1H3,(H,28,33)(H,27,29,30)/t16-/m0/s1 |
|
| inchikey |
WEAJZXNPAWBCOA-INIZCTEOSA-N |
|
| label |
avanafil |
|
| mass |
483.95100 |
|
| monoisotopicmass |
483.17857 |
|
| notation |
CHEBI:66876 |
|
| prefLabel |
avanafil |
|
| smiles |
COc1ccc(CNc2nc(ncc2C(=O)NCc2ncccn2)N2CCC[C@H]2CO)cc1Cl |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_62733 http://purl.obolibrary.org/obo/CHEBI_36683 http://purl.obolibrary.org/obo/CHEBI_59654 |