N-[1-(1-adamantyl)propyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[1-(1-adamantyl)propyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[1-(1-adamantyl)propyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[1-(1-adamantyl)propyl]-2-(1-ethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[1-(1-adamantyl)propyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[1-(1-adamantyl)propyl]-2-(1-ethylpyrazol-4-yl)cinchoninamide Formula: C28H34N4O MolecularWeight: 442.59576

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CN(N=C6)CC

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=CC(=NC5=CC=CC=C54)C6=CN(N=C6)CC

InChI

InChI=1S/C28H34N4O/c1-3-26(28-13-18-9-19(14-28)11-20(10-18)15-28)31-27(33)23-12-25(21-16-29-32(4-2)17-21)30-24-8-6-5-7-22(23)24/h5-8,12,16-20,26H,3-4,9-11,13-15H2,1-2H3,(H,31,33)