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2-[2-azanyl-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

2-[2-azanyl-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol

Systemtic Name:2-[2-azanyl-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Openeye Name:2-[2-amino-6-(p-tolylmethylsulfanyl)purin-9-yl]-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
CAS Name:2-[2-amino-6-[(4-methylphenyl)methylthio]-9-purinyl]-5-(hydroxymethyl)oxolane-3,4-diol
IUPAC Name:2-[2-amino-6-[(4-methylphenyl)methylsulfanyl]purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Traditional Name:2-[2-amino-6-[(4-methylbenzyl)thio]purin-9-yl]-5-methylol-tetrahydrofuran-3,4-diol
Formula: C18H21N5O4S
MolecularWeight: 403.45544
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)N


Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=NC3=C2N=CN3C4C(C(C(O4)CO)O)O)N


InChI

InChI=1S/C18H21N5O4S/c1-9-2-4-10(5-3-9)7-28-16-12-15(21-18(19)22-16)23(8-20-12)17-14(26)13(25)11(6-24)27-17/h2-5,8,11,13-14,17,24-26H,6-7H2,1H3,(H2,19,21,22)


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