loading...| Preferred Name | rilpivirine | |
| Synonyms |
rilpivirine 4-{[4-({4-[(E)-2-cyanovinyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile TMC 278 TMC278 4-{[4-({4-[(E)-2-cyanoethenyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile |
|
| Definitions |
An aminopyrimidine that is pyrimidine-2,4-diamine in which the amino groups at positions 2 and 4 are substituted by 4-cyanophenyl and 4-[(E)-2-cyanovinyl]-2,6-dimethylphenyl groups respectively. Used for treatment of HIV. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_68606 |
|
| alternative term |
rilpivirine 4-{[4-({4-[(E)-2-cyanovinyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile TMC 278 TMC278 4-{[4-({4-[(E)-2-cyanoethenyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile |
|
| bearer of | ||
| charge |
0 |
|
| database_cross_reference |
PMID:22567823 Patent:WO2009007441 PMID:22257626 PMID:22729755 PMID:22504027 PMID:21902621 PMID:22955279 Patent:US2008280849 PMID:20438081 PMID:22293086 CAS:500287-72-9 PMID:25017682 PMID:21763935 PMID:21763936 PMID:19548857 PMID:21860365 PMID:21997204 Wikipedia:Rilpivirine PMID:21373646 PMID:19048650 PMID:22096405 Patent:WO2007113254 DrugBank:DB08864 PMID:22024527 PMID:22664973 HMDB:HMDB0061725 Patent:WO2007082922 PMID:20160045 Reaxys:9952270 PMID:22406117 PMID:21308448 PMID:22209291 PMID:22878339 PMID:22842995 PMID:15771449 PMID:15771441 PMID:22356290 PMID:22570576 Patent:WO2006035069 Patent:WO2006035068 Patent:WO2006035067 PMID:22921088 KEGG:D09720 PMID:19249947 PMID:22519768 PDBeChem:T27 PMID:22555080 PMID:22067667 PMID:19678794 PMID:22430974 PMID:22951490 PMID:19328850 Patent:WO2004069812 PMID:22343174 Patent:WO2004016581 PMID:21763920 |
|
| definition |
An aminopyrimidine that is pyrimidine-2,4-diamine in which the amino groups at positions 2 and 4 are substituted by 4-cyanophenyl and 4-[(E)-2-cyanovinyl]-2,6-dimethylphenyl groups respectively. Used for treatment of HIV. |
|
| formula |
C22H18N6 |
|
| has_exact_synonym |
4-{[4-({4-[(E)-2-cyanoethenyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
rilpivirine 4-{[4-({4-[(E)-2-cyanovinyl]-2,6-dimethylphenyl}amino)pyrimidin-2-yl]amino}benzonitrile TMC 278 TMC278 |
|
| id |
CHEBI:68606 |
|
| in_subset | ||
| inchi |
InChI=1S/C22H18N6/c1-15-12-18(4-3-10-23)13-16(2)21(15)27-20-9-11-25-22(28-20)26-19-7-5-17(14-24)6-8-19/h3-9,11-13H,1-2H3,(H2,25,26,27,28)/b4-3+ |
|
| inchikey |
YIBOMRUWOWDFLG-ONEGZZNKSA-N |
|
| is_conjugate_base_of | ||
| label |
rilpivirine |
|
| mass |
366.41850 |
|
| monoisotopicmass |
366.15929 |
|
| notation |
CHEBI:68606 |
|
| prefLabel |
rilpivirine |
|
| RO_0000087 | ||
| smiles |
Cc1cc(\C=C\C#N)cc(C)c1Nc1ccnc(Nc2ccc(cc2)C#N)n1 |
|
| subClassOf |