9-[2-(4-ethoxyphenoxy)ethyl]-8-(2-phenoxyethylsulfanyl)purin-6-amine

Systemtic Name: 9-[2-(4-ethoxyphenoxy)ethyl]-8-(2-phenoxyethylsulfanyl)purin-6-amine Openeye Name: 9-[2-(4-ethoxyphenoxy)ethyl]-8-(2-phenoxyethylsulfanyl)purin-6-amine CAS Name: 9-[2-(4-ethoxyphenoxy)ethyl]-8-(2-phenoxyethylthio)-6-purinamine IUPAC Name: 9-[2-(4-ethoxyphenoxy)ethyl]-8-(2-phenoxyethylsulfanyl)purin-6-amine Traditional Name: [9-[2-(4-ethoxyphenoxy)ethyl]-8-(2-phenoxyethylthio)purin-6-yl]amine Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCN2C3=C(C(=NC=N3)N)N=C2SCCOC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCN2C3=C(C(=NC=N3)N)N=C2SCCOC4=CC=CC=C4

InChI

InChI=1S/C23H25N5O3S/c1-2-29-18-8-10-19(11-9-18)30-13-12-28-22-20(21(24)25-16-26-22)27-23(28)32-15-14-31-17-6-4-3-5-7-17/h3-11,16H,2,12-15H2,1H3,(H2,24,25,26)