N6-ethyl-8-(furan-2-yl)-9-phenyl-N2-(3-phenylpropyl)purine-2,6-diamine

Systemtic Name: N6-ethyl-8-(furan-2-yl)-9-phenyl-N2-(3-phenylpropyl)purine-2,6-diamine Openeye Name: N6-ethyl-8-(2-furyl)-9-phenyl-N2-(3-phenylpropyl)purine-2,6-diamine CAS Name: N6-ethyl-8-(2-furanyl)-9-phenyl-N2-(3-phenylpropyl)purine-2,6-diamine IUPAC Name: 6-N-ethyl-8-(furan-2-yl)-9-phenyl-2-N-(3-phenylpropyl)purine-2,6-diamine Traditional Name: ethyl-[8-(2-furyl)-9-phenyl-2-(3-phenylpropylamino)purin-6-yl]amine Formula: C26H26N6O MolecularWeight: 438.52424

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=NC2=C1N=C(N2C3=CC=CC=C3)C4=CC=CO4)NCCCC5=CC=CC=C5

Isomeric SMILES

CCNC1=NC(=NC2=C1N=C(N2C3=CC=CC=C3)C4=CC=CO4)NCCCC5=CC=CC=C5

InChI

InChI=1S/C26H26N6O/c1-2-27-23-22-25(31-26(30-23)28-17-9-13-19-11-5-3-6-12-19)32(20-14-7-4-8-15-20)24(29-22)21-16-10-18-33-21/h3-8,10-12,14-16,18H,2,9,13,17H2,1H3,(H2,27,28,30,31)