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

Systemtic Name: 4-(3,5-dimethoxyphenyl)-2-(2-pyridin-3-ylquinolin-4-yl)piperazine-1-carboxamide Openeye Name: 4-(3,5-dimethoxyphenyl)-2-[2-(3-pyridyl)-4-quinolyl]piperazine-1-carboxamide CAS Name: 4-(3,5-dimethoxyphenyl)-2-[2-(3-pyridinyl)-4-quinolinyl]-1-piperazinecarboxamide IUPAC Name: 4-(3,5-dimethoxyphenyl)-2-(2-pyridin-3-ylquinolin-4-yl)piperazine-1-carboxamide Traditional Name: 4-(3,5-dimethoxyphenyl)-2-[2-(3-pyridyl)-4-quinolyl]piperazine-1-carboxamide Formula: C27H27N5O3 MolecularWeight: 469.53498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)N2CCN(C(C2)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5)C(=O)N)OC

Isomeric SMILES

COC1=CC(=CC(=C1)N2CCN(C(C2)C3=CC(=NC4=CC=CC=C43)C5=CN=CC=C5)C(=O)N)OC

InChI

InChI=1S/C27H27N5O3/c1-34-20-12-19(13-21(14-20)35-2)31-10-11-32(27(28)33)26(17-31)23-15-25(18-6-5-9-29-16-18)30-24-8-4-3-7-22(23)24/h3-9,12-16,26H,10-11,17H2,1-2H3,(H2,28,33)