8-[1-methoxy-7-(3-methylsulfanylpropoxy)naphthalen-2-yl]-7H-purine

Systemtic Name: 8-[1-methoxy-7-(3-methylsulfanylpropoxy)naphthalen-2-yl]-7H-purine Openeye Name: 8-[1-methoxy-7-(3-methylsulfanylpropoxy)-2-naphthyl]-7H-purine CAS Name: 8-[1-methoxy-7-[3-(methylthio)propoxy]-2-naphthalenyl]-7H-purine IUPAC Name: 8-[1-methoxy-7-(3-methylsulfanylpropoxy)naphthalen-2-yl]-7H-purine Traditional Name: 8-[1-methoxy-7-[3-(methylthio)propoxy]-2-naphthyl]-7H-purine Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=C1C=C(C=C2)OCCCSC)C3=NC4=NC=NC=C4N3

Isomeric SMILES

COC1=C(C=CC2=C1C=C(C=C2)OCCCSC)C3=NC4=NC=NC=C4N3

InChI

InChI=1S/C20H20N4O2S/c1-25-18-15(19-23-17-11-21-12-22-20(17)24-19)7-5-13-4-6-14(10-16(13)18)26-8-3-9-27-2/h4-7,10-12H,3,8-9H2,1-2H3,(H,21,22,23,24)