N-[1-ethyl-3-(phenethylcarbamoyl)pyrazol-4-yl]-6-methyl-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[1-ethyl-3-(phenethylcarbamoyl)pyrazol-4-yl]-6-methyl-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[1-ethyl-3-(phenethylcarbamoyl)pyrazol-4-yl]-6-methyl-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[1-ethyl-3-[oxo-(phenethylamino)methyl]-4-pyrazolyl]-6-methyl-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[1-ethyl-3-(phenethylcarbamoyl)pyrazol-4-yl]-6-methyl-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[1-ethyl-3-(phenethylcarbamoyl)pyrazol-4-yl]-6-methyl-2-(4-pyridyl)cinchoninamide Formula: C30H28N6O2 MolecularWeight: 504.58232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NCCC2=CC=CC=C2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)C)C5=CC=NC=C5

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NCCC2=CC=CC=C2)NC(=O)C3=CC(=NC4=C3C=C(C=C4)C)C5=CC=NC=C5

InChI

InChI=1S/C30H28N6O2/c1-3-36-19-27(28(35-36)30(38)32-16-11-21-7-5-4-6-8-21)34-29(37)24-18-26(22-12-14-31-15-13-22)33-25-10-9-20(2)17-23(24)25/h4-10,12-15,17-19H,3,11,16H2,1-2H3,(H,32,38)(H,34,37)