N-[6-(2-methylpyrimidin-4-yl)oxyquinazolin-2-yl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[6-(2-methylpyrimidin-4-yl)oxyquinazolin-2-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[6-(2-methylpyrimidin-4-yl)oxyquinazolin-2-yl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[6-[(2-methyl-4-pyrimidinyl)oxy]-2-quinazolinyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[6-(2-methylpyrimidin-4-yl)oxyquinazolin-2-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[6-(2-methylpyrimidin-4-yl)oxyquinazolin-2-yl]-2-piperidin-1-ium-1-yl-acetamide Formula: C20H23N6O2+ MolecularWeight: 379.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=N1)OC2=CC3=CN=C(N=C3C=C2)NC(=O)C[NH+]4CCCCC4

Isomeric SMILES

CC1=NC=CC(=N1)OC2=CC3=CN=C(N=C3C=C2)NC(=O)C[NH+]4CCCCC4

InChI

InChI=1S/C20H22N6O2/c1-14-21-8-7-19(23-14)28-16-5-6-17-15(11-16)12-22-20(24-17)25-18(27)13-26-9-3-2-4-10-26/h5-8,11-12H,2-4,9-10,13H2,1H3,(H,22,24,25,27)/p+1