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

Systemtic Name: 2-cyano-2-[3-[4-(diphenylmethyl)piperazin-1-yl]quinoxalin-2-yl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[3-(4-benzhydrylpiperazin-1-yl)quinoxalin-2-yl]-N-benzyl-2-cyano-acetamide CAS Name: 2-cyano-2-[3-[4-(diphenylmethyl)-1-piperazinyl]-2-quinoxalinyl]-N-(phenylmethyl)acetamide IUPAC Name: 2-[3-(4-benzhydrylpiperazin-1-yl)quinoxalin-2-yl]-N-benzyl-2-cyanoacetamide Traditional Name: 2-[3-(4-benzhydrylpiperazino)quinoxalin-2-yl]-N-benzyl-2-cyano-acetamide Formula: C35H32N6O MolecularWeight: 552.66818

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCN1C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC4=CC=CC=C4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C35H32N6O/c36-24-29(35(42)37-25-26-12-4-1-5-13-26)32-34(39-31-19-11-10-18-30(31)38-32)41-22-20-40(21-23-41)33(27-14-6-2-7-15-27)28-16-8-3-9-17-28/h1-19,29,33H,20-23,25H2,(H,37,42)