2-(1,5-dimethylpyrazol-4-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]quinoline-4-carboxamide

Systemtic Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]quinoline-4-carboxamide Openeye Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]quinoline-4-carboxamide CAS Name: 2-(1,5-dimethyl-4-pyrazolyl)-N-[1-[3-(1-pyrrolyl)phenyl]ethyl]-4-quinolinecarboxamide IUPAC Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]quinoline-4-carboxamide Traditional Name: 2-(1,5-dimethylpyrazol-4-yl)-N-[1-(3-pyrrol-1-ylphenyl)ethyl]cinchoninamide Formula: C27H25N5O MolecularWeight: 435.5203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)C4=CC(=CC=C4)N5C=CC=C5

Isomeric SMILES

CC1=C(C=NN1C)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)C4=CC(=CC=C4)N5C=CC=C5

InChI

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