9-(2-phenoxyethyl)-8-[2-(4-propan-2-yloxyphenoxy)ethylsulfanyl]purin-6-amine

Systemtic Name: 9-(2-phenoxyethyl)-8-[2-(4-propan-2-yloxyphenoxy)ethylsulfanyl]purin-6-amine Openeye Name: 8-[2-(4-isopropoxyphenoxy)ethylsulfanyl]-9-(2-phenoxyethyl)purin-6-amine CAS Name: 9-(2-phenoxyethyl)-8-[2-(4-propan-2-yloxyphenoxy)ethylthio]-6-purinamine IUPAC Name: 9-(2-phenoxyethyl)-8-[2-(4-propan-2-yloxyphenoxy)ethylsulfanyl]purin-6-amine Traditional Name: [8-[2-(4-isopropoxyphenoxy)ethylthio]-9-(2-phenoxyethyl)purin-6-yl]amine Formula: C24H27N5O3S MolecularWeight: 465.56788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)OCCSC2=NC3=C(N2CCOC4=CC=CC=C4)N=CN=C3N

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)OCCSC2=NC3=C(N2CCOC4=CC=CC=C4)N=CN=C3N

InChI

InChI=1S/C24H27N5O3S/c1-17(2)32-20-10-8-19(9-11-20)31-14-15-33-24-28-21-22(25)26-16-27-23(21)29(24)12-13-30-18-6-4-3-5-7-18/h3-11,16-17H,12-15H2,1-2H3,(H2,25,26,27)