8-(2,5-dimethoxyphenyl)sulfanyl-3-[2-(3,4,5-trimethoxyphenyl)ethyl]purin-6-amine

Systemtic Name: 8-(2,5-dimethoxyphenyl)sulfanyl-3-[2-(3,4,5-trimethoxyphenyl)ethyl]purin-6-amine Openeye Name: 8-(2,5-dimethoxyphenyl)sulfanyl-3-[2-(3,4,5-trimethoxyphenyl)ethyl]purin-6-amine CAS Name: 8-[(2,5-dimethoxyphenyl)thio]-3-[2-(3,4,5-trimethoxyphenyl)ethyl]-6-purinamine IUPAC Name: 8-(2,5-dimethoxyphenyl)sulfanyl-3-[2-(3,4,5-trimethoxyphenyl)ethyl]purin-6-amine Traditional Name: [8-[(2,5-dimethoxyphenyl)thio]-3-[2-(3,4,5-trimethoxyphenyl)ethyl]purin-6-yl]amine Formula: C24H27N5O5S MolecularWeight: 497.56668

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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(=C(C(=C4)OC)OC)OC)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)SC2=NC3=C(N=CN(C3=N2)CCC4=CC(=C(C(=C4)OC)OC)OC)N

InChI

InChI=1S/C24H27N5O5S/c1-30-15-6-7-16(31-2)19(12-15)35-24-27-20-22(25)26-13-29(23(20)28-24)9-8-14-10-17(32-3)21(34-5)18(11-14)33-4/h6-7,10-13H,8-9,25H2,1-5H3