N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide

Systemtic Name: N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Openeye Name: N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide CAS Name: N-[2-(1-ethyl-3,5-dimethyl-4-pyrazolyl)ethyl]-2-[4-(1-oxopropylamino)phenyl]-4-quinolinecarboxamide IUPAC Name: N-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]-2-[4-(propanoylamino)phenyl]quinoline-4-carboxamide Traditional Name: N-[2-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)ethyl]-2-(4-propionamidophenyl)cinchoninamide Formula: C28H31N5O2 MolecularWeight: 469.57804

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC4=C(N(N=C4C)CC)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC4=C(N(N=C4C)CC)C

InChI

InChI=1S/C28H31N5O2/c1-5-27(34)30-21-13-11-20(12-14-21)26-17-24(23-9-7-8-10-25(23)31-26)28(35)29-16-15-22-18(3)32-33(6-2)19(22)4/h7-14,17H,5-6,15-16H2,1-4H3,(H,29,35)(H,30,34)