loading...| Preferred Name |
afatinib |
|
| Synonyms |
(2E)-N-{4-[(3-chloro-4-fluorophenyl)amino]-7-[(3S)-tetrahydrofuran-3-yloxy]quinazolin-6-yl}-4-(dimethylamino)but-2-enamide InChIKey=ULXXDDBFHOBEHA-CWDCEQMOSA-N BIBW 2992 InChI=1S/C24H25ClFN5O3/c1-31(2)8-3-4-23(32)30-21-11-17-20(12-22(21)34-16-7-9-33-13-16)27-14-28-24(17)29-15-5-6-19(26)18(25)10-15/h3-6,10-12,14,16H,7-9,13H2,1-2H3,(H,30,32)(H,27,28,29)/b4-3+/t16-/m0/s1 CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1 C24H25ClFN5O3 |
|
| Definitions |
A quinazoline compound having a 3-chloro-4-fluoroanilino group at the 4-position, a 4-dimethylamino-trans-but-2-enamido group at the 6-position, and an (S)-tetrahydrofuran-3-yloxy group at the 7-position. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_61390 |
|
| database_cross_reference |
Reaxys:11746023 ChemIDplus:850140-72-6 |
|
| definition |
A quinazoline compound having a 3-chloro-4-fluoroanilino group at the 4-position, a 4-dimethylamino-trans-but-2-enamido group at the 6-position, and an (S)-tetrahydrofuran-3-yloxy group at the 7-position. |
|
| has_exact_synonym |
(2E)-N-{4-[(3-chloro-4-fluorophenyl)amino]-7-[(3S)-tetrahydrofuran-3-yloxy]quinazolin-6-yl}-4-(dimethylamino)but-2-enamide |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
InChIKey=ULXXDDBFHOBEHA-CWDCEQMOSA-N BIBW 2992 InChI=1S/C24H25ClFN5O3/c1-31(2)8-3-4-23(32)30-21-11-17-20(12-22(21)34-16-7-9-33-13-16)27-14-28-24(17)29-15-5-6-19(26)18(25)10-15/h3-6,10-12,14,16H,7-9,13H2,1-2H3,(H,30,32)(H,27,28,29)/b4-3+/t16-/m0/s1 CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1O[C@H]1CCOC1 C24H25ClFN5O3 |
|
| id |
CHEBI:61390 |
|
| imported from | ||
| label |
afatinib |
|
| notation |
CHEBI:61390 |
|
| prefixIRI |
CHEBI:61390 |
|
| prefLabel |
afatinib |
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_24129 http://purl.obolibrary.org/obo/CHEBI_38530 |