2-[2-azanyl-6-(phenylmethylsulfanyl)purin-9-yl]ethanol

Systemtic Name: 2-[2-azanyl-6-(phenylmethylsulfanyl)purin-9-yl]ethanol Openeye Name: 2-(2-amino-6-benzylsulfanyl-purin-9-yl)ethanol CAS Name: 2-[2-amino-6-(phenylmethylthio)-9-purinyl]ethanol IUPAC Name: 2-(2-amino-6-benzylsulfanylpurin-9-yl)ethanol Traditional Name: 2-[2-amino-6-(benzylthio)purin-9-yl]ethanol Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=NC3=C2N=CN3CCO)N

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=NC3=C2N=CN3CCO)N

InChI

InChI=1S/C14H15N5OS/c15-14-17-12-11(16-9-19(12)6-7-20)13(18-14)21-8-10-4-2-1-3-5-10/h1-5,9,20H,6-8H2,(H2,15,17,18)