2-azanyl-9-[(5S)-5-(hydroxymethyl)thiolan-2-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(5S)-5-(hydroxymethyl)thiolan-2-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(5S)-5-(hydroxymethyl)tetrahydrothiophen-2-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(5S)-5-(hydroxymethyl)-2-thiolanyl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(5S)-5-(hydroxymethyl)thiolan-2-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(5S)-5-methyloltetrahydrothiophen-2-yl]-3H-purin-6-one Formula: C10H13N5O2S MolecularWeight: 267.30752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(SC1CO)N2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

C1CC(S[C@@H]1CO)N2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C10H13N5O2S/c11-10-13-8-7(9(17)14-10)12-4-15(8)6-2-1-5(3-16)18-6/h4-6,16H,1-3H2,(H3,11,13,14,17)/t5-,6?/m0/s1