9-ethyl-N2-(3-phenylpropyl)purine-2,6-diamine

Systemtic Name: 9-ethyl-N2-(3-phenylpropyl)purine-2,6-diamine Openeye Name: 9-ethyl-N2-(3-phenylpropyl)purine-2,6-diamine CAS Name: 9-ethyl-N2-(3-phenylpropyl)purine-2,6-diamine IUPAC Name: 9-ethyl-2-N-(3-phenylpropyl)purine-2,6-diamine Traditional Name: (6-amino-9-ethyl-purin-2-yl)-(3-phenylpropyl)amine Formula: C16H20N6 MolecularWeight: 296.3702

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2N)NCCCC3=CC=CC=C3

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2N)NCCCC3=CC=CC=C3

InChI

InChI=1S/C16H20N6/c1-2-22-11-19-13-14(17)20-16(21-15(13)22)18-10-6-9-12-7-4-3-5-8-12/h3-5,7-8,11H,2,6,9-10H2,1H3,(H3,17,18,20,21)