2-azanyl-9-[3-(hydroxymethyl)-4,5-bis(oxidanyl)cyclopent-2-en-1-yl]-3H-purine-6-thione

Systemtic Name: 2-azanyl-9-[3-(hydroxymethyl)-4,5-bis(oxidanyl)cyclopent-2-en-1-yl]-3H-purine-6-thione Openeye Name: 2-amino-9-[4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-purine-6-thione CAS Name: 2-amino-9-[4,5-dihydroxy-3-(hydroxymethyl)-1-cyclopent-2-enyl]-3H-purine-6-thione IUPAC Name: 2-amino-9-[4,5-dihydroxy-3-(hydroxymethyl)cyclopent-2-en-1-yl]-3H-purine-6-thione Traditional Name: 2-amino-9-(4,5-dihydroxy-3-methylol-cyclopent-2-en-1-yl)-3H-purine-6-thione Formula: C11H13N5O3S MolecularWeight: 295.31762

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(C(C1N2C=NC3=C2NC(=NC3=S)N)O)O)CO

Isomeric SMILES

C1=C(C(C(C1N2C=NC3=C2NC(=NC3=S)N)O)O)CO

InChI

InChI=1S/C11H13N5O3S/c12-11-14-9-6(10(20)15-11)13-3-16(9)5-1-4(2-17)7(18)8(5)19/h1,3,5,7-8,17-19H,2H2,(H3,12,14,15,20)