N-[[3-fluoranyl-4-[3-(3-piperazin-1-ylprop-1-ynyl)pyridin-4-yl]oxy-phenyl]carbamoyl]-2-(4-fluorophenyl)ethanamide

Systemtic Name: N-[[3-fluoranyl-4-[3-(3-piperazin-1-ylprop-1-ynyl)pyridin-4-yl]oxy-phenyl]carbamoyl]-2-(4-fluorophenyl)ethanamide Openeye Name: 2-(4-fluorophenyl)-N-[[3-fluoro-4-[[3-(3-piperazin-1-ylprop-1-ynyl)-4-pyridyl]oxy]phenyl]carbamoyl]acetamide CAS Name: 2-(4-fluorophenyl)-N-[[3-fluoro-4-[[3-[3-(1-piperazinyl)prop-1-ynyl]-4-pyridinyl]oxy]anilino]-oxomethyl]acetamide IUPAC Name: 2-(4-fluorophenyl)-N-[[3-fluoro-4-[3-(3-piperazin-1-ylprop-1-ynyl)pyridin-4-yl]oxyphenyl]carbamoyl]acetamide Traditional Name: 2-(4-fluorophenyl)-N-[[3-fluoro-4-[[3-(3-piperazinoprop-1-ynyl)-4-pyridyl]oxy]phenyl]carbamoyl]acetamide Formula: C27H25F2N5O3 MolecularWeight: 505.515906

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC#CC2=C(C=CN=C2)OC3=C(C=C(C=C3)NC(=O)NC(=O)CC4=CC=C(C=C4)F)F

Isomeric SMILES

C1CN(CCN1)CC#CC2=C(C=CN=C2)OC3=C(C=C(C=C3)NC(=O)NC(=O)CC4=CC=C(C=C4)F)F

InChI

InChI=1S/C27H25F2N5O3/c28-21-5-3-19(4-6-21)16-26(35)33-27(36)32-22-7-8-25(23(29)17-22)37-24-9-10-31-18-20(24)2-1-13-34-14-11-30-12-15-34/h3-10,17-18,30H,11-16H2,(H2,32,33,35,36)