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

Systemtic Name: N-[3-(cyclohexylcarbamoyl)-1-ethyl-pyrazol-4-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide Openeye Name: N-[3-(cyclohexylcarbamoyl)-1-ethyl-pyrazol-4-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide CAS Name: N-[3-[(cyclohexylamino)-oxomethyl]-1-ethyl-4-pyrazolyl]-2-(4-ethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-(cyclohexylcarbamoyl)-1-ethylpyrazol-4-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide Traditional Name: N-[3-(cyclohexylcarbamoyl)-1-ethyl-pyrazol-4-yl]-2-(4-ethylphenyl)cinchoninamide Formula: C30H33N5O2 MolecularWeight: 495.61532

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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)NC5CCCCC5)CC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CN(N=C4C(=O)NC5CCCCC5)CC

InChI

InChI=1S/C30H33N5O2/c1-3-20-14-16-21(17-15-20)26-18-24(23-12-8-9-13-25(23)32-26)29(36)33-27-19-35(4-2)34-28(27)30(37)31-22-10-6-5-7-11-22/h8-9,12-19,22H,3-7,10-11H2,1-2H3,(H,31,37)(H,33,36)