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

Systemtic Name: 2-cyano-2-[3-[4-(diphenylmethyl)piperazin-1-yl]quinoxalin-2-yl]-N-(3-methoxypropyl)ethanamide Openeye Name: 2-[3-(4-benzhydrylpiperazin-1-yl)quinoxalin-2-yl]-2-cyano-N-(3-methoxypropyl)acetamide CAS Name: 2-cyano-2-[3-[4-(diphenylmethyl)-1-piperazinyl]-2-quinoxalinyl]-N-(3-methoxypropyl)acetamide IUPAC Name: 2-[3-(4-benzhydrylpiperazin-1-yl)quinoxalin-2-yl]-2-cyano-N-(3-methoxypropyl)acetamide Traditional Name: 2-[3-(4-benzhydrylpiperazino)quinoxalin-2-yl]-2-cyano-N-(3-methoxypropyl)acetamide Formula: C32H34N6O2 MolecularWeight: 534.65136

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COCCCNC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C32H34N6O2/c1-40-22-10-17-34-32(39)26(23-33)29-31(36-28-16-9-8-15-27(28)35-29)38-20-18-37(19-21-38)30(24-11-4-2-5-12-24)25-13-6-3-7-14-25/h2-9,11-16,26,30H,10,17-22H2,1H3,(H,34,39)