N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-2-(4-pyridyl)cinchoninamide Formula: C22H19N7O MolecularWeight: 397.43256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)NCCCC4=C(C(=NN4)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=NC=C3)C(=O)NCCCC4=C(C(=NN4)N)C#N

InChI

InChI=1S/C22H19N7O/c23-13-17-19(28-29-21(17)24)6-3-9-26-22(30)16-12-20(14-7-10-25-11-8-14)27-18-5-2-1-4-15(16)18/h1-2,4-5,7-8,10-12H,3,6,9H2,(H,26,30)(H3,24,28,29)