4-[8-(3-cyanophenyl)quinolin-2-yl]-N-(4-ethylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[8-(3-cyanophenyl)quinolin-2-yl]-N-(4-ethylphenyl)piperazine-1-carboxamide Openeye Name: 4-[8-(3-cyanophenyl)-2-quinolyl]-N-(4-ethylphenyl)piperazine-1-carboxamide CAS Name: 4-[8-(3-cyanophenyl)-2-quinolinyl]-N-(4-ethylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[8-(3-cyanophenyl)quinolin-2-yl]-N-(4-ethylphenyl)piperazine-1-carboxamide Traditional Name: 4-[8-(3-cyanophenyl)-2-quinolyl]-N-(4-ethylphenyl)piperazine-1-carboxamide Formula: C29H27N5O MolecularWeight: 461.55758

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC4=C(C=CC=C4C5=CC=CC(=C5)C#N)C=C3

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=NC4=C(C=CC=C4C5=CC=CC(=C5)C#N)C=C3

InChI

InChI=1S/C29H27N5O/c1-2-21-9-12-25(13-10-21)31-29(35)34-17-15-33(16-18-34)27-14-11-23-6-4-8-26(28(23)32-27)24-7-3-5-22(19-24)20-30/h3-14,19H,2,15-18H2,1H3,(H,31,35)