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

Systemtic Name: 2-cyano-N-cyclohexyl-2-[3-[4-(diphenylmethyl)piperazin-1-yl]quinoxalin-2-yl]ethanamide Openeye Name: 2-[3-(4-benzhydrylpiperazin-1-yl)quinoxalin-2-yl]-2-cyano-N-cyclohexyl-acetamide CAS Name: 2-cyano-N-cyclohexyl-2-[3-[4-(diphenylmethyl)-1-piperazinyl]-2-quinoxalinyl]acetamide IUPAC Name: 2-[3-(4-benzhydrylpiperazin-1-yl)quinoxalin-2-yl]-2-cyano-N-cyclohexylacetamide Traditional Name: 2-[3-(4-benzhydrylpiperazino)quinoxalin-2-yl]-2-cyano-N-cyclohexyl-acetamide Formula: C34H36N6O MolecularWeight: 544.68924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C#N)C2=NC3=CC=CC=C3N=C2N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C#N)C2=NC3=CC=CC=C3N=C2N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C34H36N6O/c35-24-28(34(41)36-27-16-8-3-9-17-27)31-33(38-30-19-11-10-18-29(30)37-31)40-22-20-39(21-23-40)32(25-12-4-1-5-13-25)26-14-6-2-7-15-26/h1-2,4-7,10-15,18-19,27-28,32H,3,8-9,16-17,20-23H2,(H,36,41)