4-cyano-2-fluoranyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide

Systemtic Name: 4-cyano-2-fluoranyl-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide Openeye Name: 4-cyano-2-fluoro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide CAS Name: 4-cyano-2-fluoro-N-[4-[4-[(E)-1-oxo-3-phenylprop-2-enyl]-1-piperazinyl]phenyl]benzamide IUPAC Name: 4-cyano-2-fluoro-N-[4-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]phenyl]benzamide Traditional Name: 4-cyano-2-fluoro-N-[4-[4-[(E)-3-phenylacryloyl]piperazino]phenyl]benzamide Formula: C27H23FN4O2 MolecularWeight: 454.495523

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)C#N)F)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)C#N)F)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H23FN4O2/c28-25-18-21(19-29)6-12-24(25)27(34)30-22-8-10-23(11-9-22)31-14-16-32(17-15-31)26(33)13-7-20-4-2-1-3-5-20/h1-13,18H,14-17H2,(H,30,34)/b13-7+