2-(2-azanylpyrimidin-5-yl)-N,8-dimethyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide

Systemtic Name: 2-(2-azanylpyrimidin-5-yl)-N,8-dimethyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide Openeye Name: 2-(2-aminopyrimidin-5-yl)-N,8-dimethyl-N-(2-pyridylmethyl)quinoline-4-carboxamide CAS Name: 2-(2-amino-5-pyrimidinyl)-N,8-dimethyl-N-(2-pyridinylmethyl)-4-quinolinecarboxamide IUPAC Name: 2-(2-aminopyrimidin-5-yl)-N,8-dimethyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide Traditional Name: 2-(2-aminopyrimidin-5-yl)-N,8-dimethyl-N-(2-pyridylmethyl)cinchoninamide Formula: C22H20N6O MolecularWeight: 384.4338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C(=O)N(C)CC3=CC=CC=N3)C4=CN=C(N=C4)N

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C(=O)N(C)CC3=CC=CC=N3)C4=CN=C(N=C4)N

InChI

InChI=1S/C22H20N6O/c1-14-6-5-8-17-18(21(29)28(2)13-16-7-3-4-9-24-16)10-19(27-20(14)17)15-11-25-22(23)26-12-15/h3-12H,13H2,1-2H3,(H2,23,25,26)