Simotinib
Alt Names:
UNII-58K797D5IK
58K797D5IK
SIM-6802
MW:
500.90
Brutto:
C25H26ClFN4O4
SMILES:
COC1=C(C=C2C(=C1)N=CN=C2NC3=CC(=C(C=C3)F)Cl)OCCN4CC5(CC5)C6(C4)OCCO6
InChl:
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)
InChl Key:
OXWUWXCJDBRCCG-UHFFFAOYSA-N
PubChem CID:
CAS:
944258-89-3