N2-(4-morpholin-4-ylphenyl)-N6-(3-phenoxyphenyl)-7H-purine-2,6-diamine

Systemtic Name: N2-(4-morpholin-4-ylphenyl)-N6-(3-phenoxyphenyl)-7H-purine-2,6-diamine Openeye Name: N2-(4-morpholinophenyl)-N6-(3-phenoxyphenyl)-7H-purine-2,6-diamine CAS Name: N2-[4-(4-morpholinyl)phenyl]-N6-(3-phenoxyphenyl)-7H-purine-2,6-diamine IUPAC Name: 2-N-(4-morpholin-4-ylphenyl)-6-N-(3-phenoxyphenyl)-7H-purine-2,6-diamine Traditional Name: [2-(4-morpholinoanilino)-7H-purin-6-yl]-(3-phenoxyphenyl)amine Formula: C27H25N7O2 MolecularWeight: 479.5331

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC3=NC4=C(C(=N3)NC5=CC(=CC=C5)OC6=CC=CC=C6)NC=N4

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC3=NC4=C(C(=N3)NC5=CC(=CC=C5)OC6=CC=CC=C6)NC=N4

InChI

InChI=1S/C27H25N7O2/c1-2-6-22(7-3-1)36-23-8-4-5-20(17-23)30-26-24-25(29-18-28-24)32-27(33-26)31-19-9-11-21(12-10-19)34-13-15-35-16-14-34/h1-12,17-18H,13-16H2,(H3,28,29,30,31,32,33)