N-octadecyl-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-octadecyl-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-octadecyl-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-octadecyl-2-(1,3,5-trimethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-octadecyl-2-(1,3,5-trimethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-stearyl-2-(1,3,5-trimethylpyrazol-4-yl)cinchoninamide Formula: C34H52N4O MolecularWeight: 532.80288

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=C(N(N=C3C)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=C(N(N=C3C)C)C

InChI

InChI=1S/C34H52N4O/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-25-35-34(39)30-26-32(33-27(2)37-38(4)28(33)3)36-31-24-21-20-23-29(30)31/h20-21,23-24,26H,5-19,22,25H2,1-4H3,(H,35,39)