N6-cyclooctyl-N2-phenyl-7H-purine-2,6-diamine

Systemtic Name: N6-cyclooctyl-N2-phenyl-7H-purine-2,6-diamine Openeye Name: N6-cyclooctyl-N2-phenyl-7H-purine-2,6-diamine CAS Name: N6-cyclooctyl-N2-phenyl-7H-purine-2,6-diamine IUPAC Name: 6-N-cyclooctyl-2-N-phenyl-7H-purine-2,6-diamine Traditional Name: (2-anilino-7H-purin-6-yl)-cyclooctyl-amine Formula: C19H24N6 MolecularWeight: 336.43406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC2=NC(=NC3=C2NC=N3)NC4=CC=CC=C4

Isomeric SMILES

C1CCCC(CCC1)NC2=NC(=NC3=C2NC=N3)NC4=CC=CC=C4

InChI

InChI=1S/C19H24N6/c1-2-5-9-14(10-6-3-1)22-18-16-17(21-13-20-16)24-19(25-18)23-15-11-7-4-8-12-15/h4,7-8,11-14H,1-3,5-6,9-10H2,(H3,20,21,22,23,24,25)