N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide Openeye Name: N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide CAS Name: N-[3-[(cyclopentylamino)-oxomethyl]-1-ethyl-4-pyrazolyl]-2-(4-ethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-(cyclopentylcarbamoyl)-1-ethylpyrazol-4-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide Traditional Name: N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]-2-(4-ethylphenyl)cinchoninamide Formula: C29H31N5O2 MolecularWeight: 481.58874

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CN(N=C4C(=O)NC5CCCC5)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CN(N=C4C(=O)NC5CCCC5)CC

InChI

InChI=1S/C29H31N5O2/c1-3-19-13-15-20(16-14-19)25-17-23(22-11-7-8-12-24(22)31-25)28(35)32-26-18-34(4-2)33-27(26)29(36)30-21-9-5-6-10-21/h7-8,11-18,21H,3-6,9-10H2,1-2H3,(H,30,36)(H,32,35)