2-(4-tert-butylphenyl)-N-[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-tert-butylphenyl)-N-[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]quinoline-4-carboxamide Openeye Name: 2-(4-tert-butylphenyl)-N-[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]quinoline-4-carboxamide CAS Name: 2-(4-tert-butylphenyl)-N-[(1S)-1-(1-ethyl-3-methyl-4-pyrazolyl)ethyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-tert-butylphenyl)-N-[(1S)-1-(1-ethyl-3-methylpyrazol-4-yl)ethyl]quinoline-4-carboxamide Traditional Name: 2-(4-tert-butylphenyl)-N-[(1S)-1-(1-ethyl-3-methyl-pyrazol-4-yl)ethyl]cinchoninamide Formula: C28H32N4O MolecularWeight: 440.57988

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C(C)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCN1C=C(C(=N1)C)[C@H](C)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C28H32N4O/c1-7-32-17-24(19(3)31-32)18(2)29-27(33)23-16-26(30-25-11-9-8-10-22(23)25)20-12-14-21(15-13-20)28(4,5)6/h8-18H,7H2,1-6H3,(H,29,33)/t18-/m0/s1