2-(2-azanylpyrimidin-5-yl)-N-ethyl-5,7-dimethyl-N-propyl-quinoline-4-carboxamide

Systemtic Name: 2-(2-azanylpyrimidin-5-yl)-N-ethyl-5,7-dimethyl-N-propyl-quinoline-4-carboxamide Openeye Name: 2-(2-aminopyrimidin-5-yl)-N-ethyl-5,7-dimethyl-N-propyl-quinoline-4-carboxamide CAS Name: 2-(2-amino-5-pyrimidinyl)-N-ethyl-5,7-dimethyl-N-propyl-4-quinolinecarboxamide IUPAC Name: 2-(2-aminopyrimidin-5-yl)-N-ethyl-5,7-dimethyl-N-propylquinoline-4-carboxamide Traditional Name: 2-(2-aminopyrimidin-5-yl)-N-ethyl-5,7-dimethyl-N-propyl-cinchoninamide Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC)C(=O)C1=CC(=NC2=CC(=CC(=C12)C)C)C3=CN=C(N=C3)N

Isomeric SMILES

CCCN(CC)C(=O)C1=CC(=NC2=CC(=CC(=C12)C)C)C3=CN=C(N=C3)N

InChI

InChI=1S/C21H25N5O/c1-5-7-26(6-2)20(27)16-10-17(15-11-23-21(22)24-12-15)25-18-9-13(3)8-14(4)19(16)18/h8-12H,5-7H2,1-4H3,(H2,22,23,24)