8-(furan-2-yl)-N2-phenethyl-9-(1-pyridin-4-ylpropyl)purine-2,6-diamine

Systemtic Name: 8-(furan-2-yl)-N2-phenethyl-9-(1-pyridin-4-ylpropyl)purine-2,6-diamine Openeye Name: 8-(2-furyl)-N2-phenethyl-9-[1-(4-pyridyl)propyl]purine-2,6-diamine CAS Name: 8-(2-furanyl)-N2-phenethyl-9-(1-pyridin-4-ylpropyl)purine-2,6-diamine IUPAC Name: 8-(furan-2-yl)-2-N-phenethyl-9-(1-pyridin-4-ylpropyl)purine-2,6-diamine Traditional Name: [6-amino-8-(2-furyl)-9-[1-(4-pyridyl)propyl]purin-2-yl]-phenethyl-amine Formula: C25H25N7O MolecularWeight: 439.5123

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=NC=C1)N2C3=C(C(=NC(=N3)NCCC4=CC=CC=C4)N)N=C2C5=CC=CO5

Isomeric SMILES

CCC(C1=CC=NC=C1)N2C3=C(C(=NC(=N3)NCCC4=CC=CC=C4)N)N=C2C5=CC=CO5

InChI

InChI=1S/C25H25N7O/c1-2-19(18-11-13-27-14-12-18)32-23(20-9-6-16-33-20)29-21-22(26)30-25(31-24(21)32)28-15-10-17-7-4-3-5-8-17/h3-9,11-14,16,19H,2,10,15H2,1H3,(H3,26,28,30,31)