8-(furan-2-yl)-9-[(E)-hept-4-enyl]-N2-(3-phenylpropyl)purine-2,6-diamine

Systemtic Name: 8-(furan-2-yl)-9-[(E)-hept-4-enyl]-N2-(3-phenylpropyl)purine-2,6-diamine Openeye Name: 8-(2-furyl)-9-[(E)-hept-4-enyl]-N2-(3-phenylpropyl)purine-2,6-diamine CAS Name: 8-(2-furanyl)-9-[(E)-hept-4-enyl]-N2-(3-phenylpropyl)purine-2,6-diamine IUPAC Name: 8-(furan-2-yl)-9-[(E)-hept-4-enyl]-2-N-(3-phenylpropyl)purine-2,6-diamine Traditional Name: [6-amino-8-(2-furyl)-9-[(E)-hept-4-enyl]purin-2-yl]-(3-phenylpropyl)amine Formula: C25H30N6O MolecularWeight: 430.5453

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCCCN1C2=C(C(=NC(=N2)NCCCC3=CC=CC=C3)N)N=C1C4=CC=CO4

Isomeric SMILES

CC/C=C/CCCN1C2=C(C(=NC(=N2)NCCCC3=CC=CC=C3)N)N=C1C4=CC=CO4

InChI

InChI=1S/C25H30N6O/c1-2-3-4-5-9-17-31-23(20-15-11-18-32-20)28-21-22(26)29-25(30-24(21)31)27-16-10-14-19-12-7-6-8-13-19/h3-4,6-8,11-13,15,18H,2,5,9-10,14,16-17H2,1H3,(H3,26,27,29,30)/b4-3+