N-[3-[6-(2-azanylpyrimidin-5-yl)-2-morpholin-4-yl-pyrimidin-4-yl]phenyl]ethanamide

Systemtic Name: N-[3-[6-(2-azanylpyrimidin-5-yl)-2-morpholin-4-yl-pyrimidin-4-yl]phenyl]ethanamide Openeye Name: N-[3-[6-(2-aminopyrimidin-5-yl)-2-morpholino-pyrimidin-4-yl]phenyl]acetamide CAS Name: N-[3-[6-(2-amino-5-pyrimidinyl)-2-(4-morpholinyl)-4-pyrimidinyl]phenyl]acetamide IUPAC Name: N-[3-[6-(2-aminopyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]phenyl]acetamide Traditional Name: N-[3-[6-(2-aminopyrimidin-5-yl)-2-morpholino-pyrimidin-4-yl]phenyl]acetamide Formula: C20H21N7O2 MolecularWeight: 391.42644

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)C2=CC(=NC(=N2)N3CCOCC3)C4=CN=C(N=C4)N

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)C2=CC(=NC(=N2)N3CCOCC3)C4=CN=C(N=C4)N

InChI

InChI=1S/C20H21N7O2/c1-13(28)24-16-4-2-3-14(9-16)17-10-18(15-11-22-19(21)23-12-15)26-20(25-17)27-5-7-29-8-6-27/h2-4,9-12H,5-8H2,1H3,(H,24,28)(H2,21,22,23)