N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-2-pyridin-2-yl-quinoline-4-carboxamide

Systemtic Name: N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: N-[2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl]-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl]-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: N-[2-[4-(4-methoxyphenyl)piperazino]ethyl]-2-(2-pyridyl)cinchoninamide Formula: C28H29N5O2 MolecularWeight: 467.56216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCNC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=N5

InChI

InChI=1S/C28H29N5O2/c1-35-22-11-9-21(10-12-22)33-18-16-32(17-19-33)15-14-30-28(34)24-20-27(26-8-4-5-13-29-26)31-25-7-3-2-6-23(24)25/h2-13,20H,14-19H2,1H3,(H,30,34)