3-[1-(6-methylsulfanylpurin-9-yl)ethyl]phenol

Systemtic Name: 3-[1-(6-methylsulfanylpurin-9-yl)ethyl]phenol Openeye Name: 3-[1-(6-methylsulfanylpurin-9-yl)ethyl]phenol CAS Name: 3-[1-[6-(methylthio)-9-purinyl]ethyl]phenol IUPAC Name: 3-[1-(6-methylsulfanylpurin-9-yl)ethyl]phenol Traditional Name: 3-[1-[6-(methylthio)purin-9-yl]ethyl]phenol Formula: C14H14N4OS MolecularWeight: 286.35216

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)O)N2C=NC3=C2N=CN=C3SC

Isomeric SMILES

CC(C1=CC(=CC=C1)O)N2C=NC3=C2N=CN=C3SC

InChI

InChI=1S/C14H14N4OS/c1-9(10-4-3-5-11(19)6-10)18-8-17-12-13(18)15-7-16-14(12)20-2/h3-9,19H,1-2H3