3-[6-(2-azanylpyrimidin-5-yl)-2-morpholin-4-yl-pyrimidin-4-yl]oxy-N-methyl-benzamide

Systemtic Name: 3-[6-(2-azanylpyrimidin-5-yl)-2-morpholin-4-yl-pyrimidin-4-yl]oxy-N-methyl-benzamide Openeye Name: 3-[6-(2-aminopyrimidin-5-yl)-2-morpholino-pyrimidin-4-yl]oxy-N-methyl-benzamide CAS Name: 3-[[6-(2-amino-5-pyrimidinyl)-2-(4-morpholinyl)-4-pyrimidinyl]oxy]-N-methylbenzamide IUPAC Name: 3-[6-(2-aminopyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]oxy-N-methylbenzamide Traditional Name: 3-[6-(2-aminopyrimidin-5-yl)-2-morpholino-pyrimidin-4-yl]oxy-N-methyl-benzamide Formula: C20H21N7O3 MolecularWeight: 407.42584

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)OC2=NC(=NC(=C2)C3=CN=C(N=C3)N)N4CCOCC4

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)OC2=NC(=NC(=C2)C3=CN=C(N=C3)N)N4CCOCC4

InChI

InChI=1S/C20H21N7O3/c1-22-18(28)13-3-2-4-15(9-13)30-17-10-16(14-11-23-19(21)24-12-14)25-20(26-17)27-5-7-29-8-6-27/h2-4,9-12H,5-8H2,1H3,(H,22,28)(H2,21,23,24)