6-azanyl-9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purine-8-carbothialdehyde

Systemtic Name: 6-azanyl-9-[5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]purine-8-carbothialdehyde Openeye Name: 6-amino-9-[4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]purine-8-carbothialdehyde CAS Name: 6-amino-9-[4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-8-purinecarbothioaldehyde IUPAC Name: 6-amino-9-[4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purine-8-carbothialdehyde Traditional Name: 6-amino-9-(4-hydroxy-5-methylol-tetrahydrofuran-2-yl)purine-8-carbothialdehyde Formula: C11H13N5O3S MolecularWeight: 295.31762

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C(=NC3=C2N=CN=C3N)C=S)CO)O

Isomeric SMILES

C1C(C(OC1N2C(=NC3=C2N=CN=C3N)C=S)CO)O

InChI

InChI=1S/C11H13N5O3S/c12-10-9-11(14-4-13-10)16(7(3-20)15-9)8-1-5(18)6(2-17)19-8/h3-6,8,17-18H,1-2H2,(H2,12,13,14)