2-(2-azanylpyrimidin-5-yl)-N-cycloheptyl-7-fluoranyl-quinoline-4-carboxamide

Systemtic Name: 2-(2-azanylpyrimidin-5-yl)-N-cycloheptyl-7-fluoranyl-quinoline-4-carboxamide Openeye Name: 2-(2-aminopyrimidin-5-yl)-N-cycloheptyl-7-fluoro-quinoline-4-carboxamide CAS Name: 2-(2-amino-5-pyrimidinyl)-N-cycloheptyl-7-fluoro-4-quinolinecarboxamide IUPAC Name: 2-(2-aminopyrimidin-5-yl)-N-cycloheptyl-7-fluoroquinoline-4-carboxamide Traditional Name: 2-(2-aminopyrimidin-5-yl)-N-cycloheptyl-7-fluoro-cinchoninamide Formula: C21H22FN5O MolecularWeight: 379.430683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=CC(=NC3=C2C=CC(=C3)F)C4=CN=C(N=C4)N

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=CC(=NC3=C2C=CC(=C3)F)C4=CN=C(N=C4)N

InChI

InChI=1S/C21H22FN5O/c22-14-7-8-16-17(20(28)26-15-5-3-1-2-4-6-15)10-18(27-19(16)9-14)13-11-24-21(23)25-12-13/h7-12,15H,1-6H2,(H,26,28)(H2,23,24,25)