2-(1-ethylpyrazol-4-yl)-N-(2,4,4-trimethylpentan-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-(1-ethylpyrazol-4-yl)-N-(2,4,4-trimethylpentan-2-yl)quinoline-4-carboxamide Openeye Name: 2-(1-ethylpyrazol-4-yl)-N-(1,1,3,3-tetramethylbutyl)quinoline-4-carboxamide CAS Name: 2-(1-ethyl-4-pyrazolyl)-N-(2,4,4-trimethylpentan-2-yl)-4-quinolinecarboxamide IUPAC Name: 2-(1-ethylpyrazol-4-yl)-N-(2,4,4-trimethylpentan-2-yl)quinoline-4-carboxamide Traditional Name: 2-(1-ethylpyrazol-4-yl)-N-(1,1,3,3-tetramethylbutyl)cinchoninamide Formula: C23H30N4O MolecularWeight: 378.5105

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)(C)CC(C)(C)C

Isomeric SMILES

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)(C)CC(C)(C)C

InChI

InChI=1S/C23H30N4O/c1-7-27-14-16(13-24-27)20-12-18(17-10-8-9-11-19(17)25-20)21(28)26-23(5,6)15-22(2,3)4/h8-14H,7,15H2,1-6H3,(H,26,28)