2-(1,3-dimethylpyrazol-4-yl)-N-(3-morpholin-4-ylpropyl)quinoline-4-carboxamide

Systemtic Name: 2-(1,3-dimethylpyrazol-4-yl)-N-(3-morpholin-4-ylpropyl)quinoline-4-carboxamide Openeye Name: 2-(1,3-dimethylpyrazol-4-yl)-N-(3-morpholinopropyl)quinoline-4-carboxamide CAS Name: 2-(1,3-dimethyl-4-pyrazolyl)-N-[3-(4-morpholinyl)propyl]-4-quinolinecarboxamide IUPAC Name: 2-(1,3-dimethylpyrazol-4-yl)-N-(3-morpholin-4-ylpropyl)quinoline-4-carboxamide Traditional Name: 2-(1,3-dimethylpyrazol-4-yl)-N-(3-morpholinopropyl)cinchoninamide Formula: C22H27N5O2 MolecularWeight: 393.48208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCOCC4)C

Isomeric SMILES

CC1=NN(C=C1C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCOCC4)C

InChI

InChI=1S/C22H27N5O2/c1-16-19(15-26(2)25-16)21-14-18(17-6-3-4-7-20(17)24-21)22(28)23-8-5-9-27-10-12-29-13-11-27/h3-4,6-7,14-15H,5,8-13H2,1-2H3,(H,23,28)