N-(2-adamantyl)-2-(1-ethyl-5-methyl-pyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-(2-adamantyl)-2-(1-ethyl-5-methyl-pyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-(2-adamantyl)-2-(1-ethyl-5-methyl-pyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-(2-adamantyl)-2-(1-ethyl-5-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-(2-adamantyl)-2-(1-ethyl-5-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(2-adamantyl)-2-(1-ethyl-5-methyl-pyrazol-4-yl)cinchoninamide Formula: C26H30N4O MolecularWeight: 414.5426

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4C5CC6CC(C5)CC4C6)C

Isomeric SMILES

CCN1C(=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4C5CC6CC(C5)CC4C6)C

InChI

InChI=1S/C26H30N4O/c1-3-30-15(2)22(14-27-30)24-13-21(20-6-4-5-7-23(20)28-24)26(31)29-25-18-9-16-8-17(11-18)12-19(25)10-16/h4-7,13-14,16-19,25H,3,8-12H2,1-2H3,(H,29,31)