Simotinib(944258-89-3)名称与标识符
名称
英文别名:
Simotinib;58K797D5IK;SIM6802;GTPL7640;SIM 6802;AL6802;AL 6802;Q27088802;4-QUINAZOLINAMINE, N-(3-CHLORO-4-FLUOROPHENYL)-6-(2-(5,8-DIOXA-10-AZADISPIRO(2.0.4.3)UNDEC-10-YL)ETHOXY)-7-METHOXY-;CS-0021918;N-(3-chloro-4-fluorophenyl)-6-[2-(5,8-dioxa-10-azadispiro[2.0.44.33]undecan-10-yl)ethoxy]-7-methoxyquinazolin-4-amine;MS-29304;N-(3-chloro-4-fluorophenyl)-6-(2-(5, 8-dioxa-11-azadispiro(2.0.4.3)undec-11-yl)ethoxy)-7-methoxy-4-quinazolinamine;N-(3-chloro-4-fluorophenyl)-6-(2-(5,8-dioxa-10-azadispiro(2.0.4^(4).3^(3))undecan-10-yl)ethoxy)-7-methoxyquinazolin-4-amine;CHEMBL3545235;N-(3-chloro-4-fluorophenyl)-6-[2-(5,8-dioxa-10-azadispiro[2.0.4^{4}.3^{3}]undecan-10-yl)ethoxy]-7-methoxyquinazolin-4-amine;HY-101820;944258-89-3;SIM-6802;AKOS040754924;SCHEMBL21501502;G17874;UNII-58K797D5IK;N-(3-chloro-4-fluorophenyl)-6-(2-(5,8-dioxa-11-azadispiro(2.0.4.3)undec-11-yl)ethoxy)-7-methoxy-4-quinazolinamine;
标识符
InChIKey:
OXWUWXCJDBRCCG-UHFFFAOYSA-N
Inchi:
1S/C25H26ClFN4O4/c1-32-21-12-20-17(23(29-15-28-20)30-16-2-3-19(27)18(26)10-16)11-22(21)33-7-6-31-13-24(4-5-24)25(14-31)34-8-9-35-25/h2-3,10-12,15H,4-9,13-14H2,1H3,(H,28,29,30)
SMILES:
ClC1=C(C=CC(=C1)NC1=C2C(C=C(C(=C2)OCCN2CC3(C4(C2)CC4)OCCO3)OC)=NC=N1)F