2-cyano-2-[3-[4-(4-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-cyano-2-[3-[4-(4-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-cyano-2-[3-[4-(4-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl]acetamide CAS Name: 2-cyano-2-[3-[4-(4-fluorophenyl)-1-piperazinyl]-2-quinoxalinyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-cyano-2-[3-[4-(4-fluorophenyl)piperazin-1-yl]quinoxalin-2-yl]acetamide Traditional Name: N-benzyl-2-cyano-2-[3-[4-(4-fluorophenyl)piperazino]quinoxalin-2-yl]acetamide Formula: C28H25FN6O MolecularWeight: 480.536103

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C3=NC4=CC=CC=C4N=C3C(C#N)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C28H25FN6O/c29-21-10-12-22(13-11-21)34-14-16-35(17-15-34)27-26(32-24-8-4-5-9-25(24)33-27)23(18-30)28(36)31-19-20-6-2-1-3-7-20/h1-13,23H,14-17,19H2,(H,31,36)