8-(2-methoxy-4-methylsulfanyl-phenyl)-2-phenylmethoxy-7H-purine

Systemtic Name: 8-(2-methoxy-4-methylsulfanyl-phenyl)-2-phenylmethoxy-7H-purine Openeye Name: 2-benzyloxy-8-(2-methoxy-4-methylsulfanyl-phenyl)-7H-purine CAS Name: 8-[2-methoxy-4-(methylthio)phenyl]-2-phenylmethoxy-7H-purine IUPAC Name: 8-(2-methoxy-4-methylsulfanylphenyl)-2-phenylmethoxy-7H-purine Traditional Name: 2-benzoxy-8-[2-methoxy-4-(methylthio)phenyl]-7H-purine Formula: C20H18N4O2S MolecularWeight: 378.44752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)SC)C2=NC3=NC(=NC=C3N2)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)SC)C2=NC3=NC(=NC=C3N2)OCC4=CC=CC=C4

InChI

InChI=1S/C20H18N4O2S/c1-25-17-10-14(27-2)8-9-15(17)18-22-16-11-21-20(24-19(16)23-18)26-12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,21,22,23,24)