[2-[(2-ethylphenyl)amino]quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [2-[(2-ethylphenyl)amino]quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [2-(2-ethylanilino)-4-quinolyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [2-(2-ethylanilino)-4-quinolinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [2-(2-ethylanilino)quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [2-(2-ethylanilino)-4-quinolyl]-(4-phenylpiperazino)methanone Formula: C28H28N4O MolecularWeight: 436.54812

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CCC1=CC=CC=C1NC2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H28N4O/c1-2-21-10-6-8-14-25(21)29-27-20-24(23-13-7-9-15-26(23)30-27)28(33)32-18-16-31(17-19-32)22-11-4-3-5-12-22/h3-15,20H,2,16-19H2,1H3,(H,29,30)