4-(3-methoxyphenyl)-1-pyrimidin-2-yl-N-quinolin-5-yl-piperidine-4-carboxamide

Systemtic Name: 4-(3-methoxyphenyl)-1-pyrimidin-2-yl-N-quinolin-5-yl-piperidine-4-carboxamide Openeye Name: 4-(3-methoxyphenyl)-1-pyrimidin-2-yl-N-(5-quinolyl)piperidine-4-carboxamide CAS Name: 4-(3-methoxyphenyl)-1-(2-pyrimidinyl)-N-(5-quinolinyl)-4-piperidinecarboxamide IUPAC Name: 4-(3-methoxyphenyl)-1-pyrimidin-2-yl-N-quinolin-5-ylpiperidine-4-carboxamide Traditional Name: 4-(3-methoxyphenyl)-1-(2-pyrimidyl)-N-(5-quinolyl)isonipecotamide Formula: C26H25N5O2 MolecularWeight: 439.509

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCN(CC2)C3=NC=CC=N3)C(=O)NC4=CC=CC5=C4C=CC=N5

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCN(CC2)C3=NC=CC=N3)C(=O)NC4=CC=CC5=C4C=CC=N5

InChI

InChI=1S/C26H25N5O2/c1-33-20-7-2-6-19(18-20)26(11-16-31(17-12-26)25-28-14-5-15-29-25)24(32)30-23-10-3-9-22-21(23)8-4-13-27-22/h2-10,13-15,18H,11-12,16-17H2,1H3,(H,30,32)