2-cyano-N-phenethyl-2-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxalin-2-yl]ethanamide

Systemtic Name: 2-cyano-N-phenethyl-2-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxalin-2-yl]ethanamide Openeye Name: 2-cyano-N-phenethyl-2-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxalin-2-yl]acetamide CAS Name: 2-cyano-N-phenethyl-2-[3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-2-quinoxalinyl]acetamide IUPAC Name: 2-cyano-N-phenethyl-2-[3-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]quinoxalin-2-yl]acetamide Traditional Name: 2-cyano-N-phenethyl-2-[3-[4-[3-(trifluoromethyl)phenyl]piperazino]quinoxalin-2-yl]acetamide Formula: C30H27F3N6O MolecularWeight: 544.57019

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)NCCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC(=C2)C(F)(F)F)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C30H27F3N6O/c31-30(32,33)22-9-6-10-23(19-22)38-15-17-39(18-16-38)28-27(36-25-11-4-5-12-26(25)37-28)24(20-34)29(40)35-14-13-21-7-2-1-3-8-21/h1-12,19,24H,13-18H2,(H,35,40)