2-(1-ethylpyrazol-4-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]quinoline-4-carboxamide

Systemtic Name: 2-(1-ethylpyrazol-4-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]quinoline-4-carboxamide Openeye Name: 2-(1-ethylpyrazol-4-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]quinoline-4-carboxamide CAS Name: 2-(1-ethyl-4-pyrazolyl)-N-[1-[3-(1-pyrrolyl)phenyl]ethyl]-4-quinolinecarboxamide IUPAC Name: 2-(1-ethylpyrazol-4-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]quinoline-4-carboxamide Traditional Name: 2-(1-ethylpyrazol-4-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]cinchoninamide Formula: C27H25N5O MolecularWeight: 435.5203

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)C4=CC(=CC=C4)N5C=CC=C5

Isomeric SMILES

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)C4=CC(=CC=C4)N5C=CC=C5

InChI

InChI=1S/C27H25N5O/c1-3-32-18-21(17-28-32)26-16-24(23-11-4-5-12-25(23)30-26)27(33)29-19(2)20-9-8-10-22(15-20)31-13-6-7-14-31/h4-19H,3H2,1-2H3,(H,29,33)