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

Systemtic Name: N6-cyclohexyl-N2-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine Openeye Name: N6-cyclohexyl-N2-(4-morpholinophenyl)-7H-purine-2,6-diamine CAS Name: N6-cyclohexyl-N2-[4-(4-morpholinyl)phenyl]-7H-purine-2,6-diamine IUPAC Name: 6-N-cyclohexyl-2-N-(4-morpholin-4-ylphenyl)-7H-purine-2,6-diamine Traditional Name: cyclohexyl-[2-(4-morpholinoanilino)-7H-purin-6-yl]amine Formula: C21H27N7O MolecularWeight: 393.48538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)N5CCOCC5

Isomeric SMILES

C1CCC(CC1)NC2=NC(=NC3=C2NC=N3)NC4=CC=C(C=C4)N5CCOCC5

InChI

InChI=1S/C21H27N7O/c1-2-4-15(5-3-1)24-20-18-19(23-14-22-18)26-21(27-20)25-16-6-8-17(9-7-16)28-10-12-29-13-11-28/h6-9,14-15H,1-5,10-13H2,(H3,22,23,24,25,26,27)