2-(6-azanyl-2-chloranyl-purin-9-yl)-5-(hydroxymethyl)thiolane-3,4-diol

Systemtic Name: 2-(6-azanyl-2-chloranyl-purin-9-yl)-5-(hydroxymethyl)thiolane-3,4-diol Openeye Name: 2-(6-amino-2-chloro-purin-9-yl)-5-(hydroxymethyl)tetrahydrothiophene-3,4-diol CAS Name: 2-(6-amino-2-chloro-9-purinyl)-5-(hydroxymethyl)thiolane-3,4-diol IUPAC Name: 2-(6-amino-2-chloropurin-9-yl)-5-(hydroxymethyl)thiolane-3,4-diol Traditional Name: 2-(6-amino-2-chloro-purin-9-yl)-5-methylol-tetrahydrothiophene-3,4-diol Formula: C10H12ClN5O3S MolecularWeight: 317.75198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(N1C3C(C(C(S3)CO)O)O)N=C(N=C2N)Cl

Isomeric SMILES

C1=NC2=C(N1C3C(C(C(S3)CO)O)O)N=C(N=C2N)Cl

InChI

InChI=1S/C10H12ClN5O3S/c11-10-14-7(12)4-8(15-10)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H2,12,14,15)