ND1

(2Z)-N,N-dimethyl-4-{[2-({5-[(1Z)-4,4,4-trifluoro-1-(3-fluoro-2H-indazol-5-yl)-2-phenylbut-1-en-1-yl]pyridin-2-yl}oxy)ethyl]amino}but-2-enamide


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Chemical Component Summary

Name(2Z)-N,N-dimethyl-4-{[2-({5-[(1Z)-4,4,4-trifluoro-1-(3-fluoro-2H-indazol-5-yl)-2-phenylbut-1-en-1-yl]pyridin-2-yl}oxy)ethyl]amino}but-2-enamide
Identifiers~{N},~{N}-dimethyl-4-[2-[5-[(~{Z})-4,4,4-tris(fluoranyl)-1-(3-fluoranyl-2~{H}-indazol-5-yl)-2-phenyl-but-1-enyl]pyridin-2-yl]oxyethylamino]but-2-enamide
FormulaC30 H29 F4 N5 O2
Molecular Weight567.577
TypeNON-POLYMER
Isomeric SMILESCN(C)C(=O)C=CCNCCOc1ccc(cn1)/C(=C(/CC(F)(F)F)\c2ccccc2)/c3ccc4c(c3)c([nH]n4)F
InChIInChI=1S/C30H29F4N5O2/c1-39(2)27(40)9-6-14-35-15-16-41-26-13-11-22(19-36-26)28(21-10-12-25-23(17-21)29(31)38-37-25)24(18-30(32,33)34)20-7-4-3-5-8-20/h3-13,17,19,35H,14-16,18H2,1-2H3,(H,37,38)/b9-6?,28-24-
InChIKeyJPFTZIJTXCHJNE-LTZHIIGJSA-N

Chemical Details

Formal Charge0
Atom Count70
Chiral Atom Count0
Bond Count73
Aromatic Bond Count22