2-(4-fluoranylphenoxy)-N-(3-methylphenyl)-6-morpholin-4-yl-7H-purin-8-amine

Systemtic Name: 2-(4-fluoranylphenoxy)-N-(3-methylphenyl)-6-morpholin-4-yl-7H-purin-8-amine Openeye Name: 2-(4-fluorophenoxy)-6-morpholino-N-(m-tolyl)-7H-purin-8-amine CAS Name: 2-(4-fluorophenoxy)-N-(3-methylphenyl)-6-(4-morpholinyl)-7H-purin-8-amine IUPAC Name: 2-(4-fluorophenoxy)-N-(3-methylphenyl)-6-morpholin-4-yl-7H-purin-8-amine Traditional Name: [2-(4-fluorophenoxy)-6-morpholino-7H-purin-8-yl]-(m-tolyl)amine Formula: C22H21FN6O2 MolecularWeight: 420.439543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC3=C(N2)C(=NC(=N3)OC4=CC=C(C=C4)F)N5CCOCC5

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC3=C(N2)C(=NC(=N3)OC4=CC=C(C=C4)F)N5CCOCC5

InChI

InChI=1S/C22H21FN6O2/c1-14-3-2-4-16(13-14)24-21-25-18-19(26-21)27-22(31-17-7-5-15(23)6-8-17)28-20(18)29-9-11-30-12-10-29/h2-8,13H,9-12H2,1H3,(H2,24,25,26,27,28)