N-[3-(dimethylamino)propyl]-2-(1-ethyl-5-methyl-pyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[3-(dimethylamino)propyl]-2-(1-ethyl-5-methyl-pyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[3-(dimethylamino)propyl]-2-(1-ethyl-5-methyl-pyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[3-(dimethylamino)propyl]-2-(1-ethyl-5-methyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[3-(dimethylamino)propyl]-2-(1-ethyl-5-methylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[3-(dimethylamino)propyl]-2-(1-ethyl-5-methyl-pyrazol-4-yl)cinchoninamide Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN(C)C)C

Isomeric SMILES

CCN1C(=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN(C)C)C

InChI

InChI=1S/C21H27N5O/c1-5-26-15(2)18(14-23-26)20-13-17(16-9-6-7-10-19(16)24-20)21(27)22-11-8-12-25(3)4/h6-7,9-10,13-14H,5,8,11-12H2,1-4H3,(H,22,27)