(E)-1-(2-fluoranyl-4-methoxy-phenyl)-3-[2-(4-methylpiperazin-1-yl)-5-pyridin-3-yl-phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(2-fluoranyl-4-methoxy-phenyl)-3-[2-(4-methylpiperazin-1-yl)-5-pyridin-3-yl-phenyl]prop-2-en-1-one Openeye Name: (E)-1-(2-fluoro-4-methoxy-phenyl)-3-[2-(4-methylpiperazin-1-yl)-5-(3-pyridyl)phenyl]prop-2-en-1-one CAS Name: (E)-1-(2-fluoro-4-methoxyphenyl)-3-[2-(4-methyl-1-piperazinyl)-5-(3-pyridinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-1-(2-fluoro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)-5-pyridin-3-ylphenyl]prop-2-en-1-one Traditional Name: (E)-1-(2-fluoro-4-methoxy-phenyl)-3-[2-(4-methylpiperazino)-5-(3-pyridyl)phenyl]prop-2-en-1-one Formula: C26H26FN3O2 MolecularWeight: 431.501943

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C3=CN=CC=C3)C=CC(=O)C4=C(C=C(C=C4)OC)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C3=CN=CC=C3)/C=C/C(=O)C4=C(C=C(C=C4)OC)F

InChI

InChI=1S/C26H26FN3O2/c1-29-12-14-30(15-13-29)25-9-5-19(21-4-3-11-28-18-21)16-20(25)6-10-26(31)23-8-7-22(32-2)17-24(23)27/h3-11,16-18H,12-15H2,1-2H3/b10-6+