N2,N8-bis(3-ethylphenyl)-6-morpholin-4-yl-7H-purine-2,8-diamine

Systemtic Name: N2,N8-bis(3-ethylphenyl)-6-morpholin-4-yl-7H-purine-2,8-diamine Openeye Name: N2,N8-bis(3-ethylphenyl)-6-morpholino-7H-purine-2,8-diamine CAS Name: N2,N8-bis(3-ethylphenyl)-6-(4-morpholinyl)-7H-purine-2,8-diamine IUPAC Name: 2-N,8-N-bis(3-ethylphenyl)-6-morpholin-4-yl-7H-purine-2,8-diamine Traditional Name: [2-(3-ethylanilino)-6-morpholino-7H-purin-8-yl]-(3-ethylphenyl)amine Formula: C25H29N7O MolecularWeight: 443.54406

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC2=NC3=C(N2)C(=NC(=N3)NC4=CC=CC(=C4)CC)N5CCOCC5

Isomeric SMILES

CCC1=CC(=CC=C1)NC2=NC3=C(N2)C(=NC(=N3)NC4=CC=CC(=C4)CC)N5CCOCC5

InChI

InChI=1S/C25H29N7O/c1-3-17-7-5-9-19(15-17)26-24-28-21-22(29-24)30-25(27-20-10-6-8-18(4-2)16-20)31-23(21)32-11-13-33-14-12-32/h5-10,15-16H,3-4,11-14H2,1-2H3,(H3,26,27,28,29,30,31)