4-(3,5-dimethylphenyl)-N-(2-pyridin-3-ylquinolin-4-yl)piperazine-1-carboxamide

Systemtic Name: 4-(3,5-dimethylphenyl)-N-(2-pyridin-3-ylquinolin-4-yl)piperazine-1-carboxamide Openeye Name: 4-(3,5-dimethylphenyl)-N-[2-(3-pyridyl)-4-quinolyl]piperazine-1-carboxamide CAS Name: 4-(3,5-dimethylphenyl)-N-[2-(3-pyridinyl)-4-quinolinyl]-1-piperazinecarboxamide IUPAC Name: 4-(3,5-dimethylphenyl)-N-(2-pyridin-3-ylquinolin-4-yl)piperazine-1-carboxamide Traditional Name: 4-(3,5-dimethylphenyl)-N-[2-(3-pyridyl)-4-quinolyl]piperazine-1-carboxamide Formula: C27H27N5O MolecularWeight: 437.53618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2CCN(CC2)C(=O)NC3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2CCN(CC2)C(=O)NC3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5)C

InChI

InChI=1S/C27H27N5O/c1-19-14-20(2)16-22(15-19)31-10-12-32(13-11-31)27(33)30-26-17-25(21-6-5-9-28-18-21)29-24-8-4-3-7-23(24)26/h3-9,14-18H,10-13H2,1-2H3,(H,29,30,33)