N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]-8-methyl-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]-8-methyl-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]-8-methyl-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-[3-[(cyclopentylamino)-oxomethyl]-1-ethyl-4-pyrazolyl]-8-methyl-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-[3-(cyclopentylcarbamoyl)-1-ethylpyrazol-4-yl]-8-methyl-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]-8-methyl-2-(3-pyridyl)cinchoninamide Formula: C27H28N6O2 MolecularWeight: 468.55022

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2CCCC2)NC(=O)C3=CC(=NC4=C3C=CC=C4C)C5=CN=CC=C5

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2CCCC2)NC(=O)C3=CC(=NC4=C3C=CC=C4C)C5=CN=CC=C5

InChI

InChI=1S/C27H28N6O2/c1-3-33-16-23(25(32-33)27(35)29-19-10-4-5-11-19)31-26(34)21-14-22(18-9-7-13-28-15-18)30-24-17(2)8-6-12-20(21)24/h6-9,12-16,19H,3-5,10-11H2,1-2H3,(H,29,35)(H,31,34)