8-(2,5-dimethoxyphenyl)sulfanyl-3-[2-(2-methoxyphenyl)ethyl]purin-6-amine

Systemtic Name: 8-(2,5-dimethoxyphenyl)sulfanyl-3-[2-(2-methoxyphenyl)ethyl]purin-6-amine Openeye Name: 8-(2,5-dimethoxyphenyl)sulfanyl-3-[2-(2-methoxyphenyl)ethyl]purin-6-amine CAS Name: 8-[(2,5-dimethoxyphenyl)thio]-3-[2-(2-methoxyphenyl)ethyl]-6-purinamine IUPAC Name: 8-(2,5-dimethoxyphenyl)sulfanyl-3-[2-(2-methoxyphenyl)ethyl]purin-6-amine Traditional Name: [8-[(2,5-dimethoxyphenyl)thio]-3-[2-(2-methoxyphenyl)ethyl]purin-6-yl]amine Formula: C22H23N5O3S MolecularWeight: 437.51472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)SC2=NC3=C(N=CN(C3=N2)CCC4=CC=CC=C4OC)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)SC2=NC3=C(N=CN(C3=N2)CCC4=CC=CC=C4OC)N

InChI

InChI=1S/C22H23N5O3S/c1-28-15-8-9-17(30-3)18(12-15)31-22-25-19-20(23)24-13-27(21(19)26-22)11-10-14-6-4-5-7-16(14)29-2/h4-9,12-13H,10-11,23H2,1-3H3