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

Systemtic Name: N6-cyclopentyl-N2-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine Openeye Name: N6-cyclopentyl-N2-(4-morpholinophenyl)-7H-purine-2,6-diamine CAS Name: N6-cyclopentyl-N2-[4-(4-morpholinyl)phenyl]-7H-purine-2,6-diamine IUPAC Name: 6-N-cyclopentyl-2-N-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine Traditional Name: cyclopentyl-[2-(4-morpholinoanilino)-7H-purin-6-yl]amine Formula: C20H25N7O MolecularWeight: 379.4588

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

C1CCC(C1)NC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C20H25N7O/c1-2-4-14(3-1)23-19-17-18(22-13-21-17)25-20(26-19)24-15-5-7-16(8-6-15)27-9-11-28-12-10-27/h5-8,13-14H,1-4,9-12H2,(H3,21,22,23,24,25,26)