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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)C4=CC=C(C=C4)N5C=CC=C5)C

Isomeric SMILES

CC1=NN(C=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)C4=CC=C(C=C4)N5C=CC=C5)C

InChI

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