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

Systemtic Name: 2-(4-bromophenyl)-N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-N-[3-[(cyclopentylamino)-oxomethyl]-1-ethyl-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-N-[3-(cyclopentylcarbamoyl)-1-ethylpyrazol-4-yl]quinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-N-[3-(cyclopentylcarbamoyl)-1-ethyl-pyrazol-4-yl]cinchoninamide Formula: C27H26BrN5O2 MolecularWeight: 532.43164

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C(=O)NC2CCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br

Isomeric SMILES

CCN1C=C(C(=N1)C(=O)NC2CCCC2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)Br

InChI

InChI=1S/C27H26BrN5O2/c1-2-33-16-24(25(32-33)27(35)29-19-7-3-4-8-19)31-26(34)21-15-23(17-11-13-18(28)14-12-17)30-22-10-6-5-9-20(21)22/h5-6,9-16,19H,2-4,7-8H2,1H3,(H,29,35)(H,31,34)