2-azanyl-9-[(1S,4S,5R)-6-thiabicyclo[3.1.0]hexan-4-yl]-3H-purin-6-one

Systemtic Name: 2-azanyl-9-[(1S,4S,5R)-6-thiabicyclo[3.1.0]hexan-4-yl]-3H-purin-6-one Openeye Name: 2-amino-9-[(1S,4S,5R)-6-thiabicyclo[3.1.0]hexan-4-yl]-3H-purin-6-one CAS Name: 2-amino-9-[(1S,4S,5R)-6-thiabicyclo[3.1.0]hexan-4-yl]-3H-purin-6-one IUPAC Name: 2-amino-9-[(1S,4S,5R)-6-thiabicyclo[3.1.0]hexan-4-yl]-3H-purin-6-one Traditional Name: 2-amino-9-[(1S,4S,5R)-6-thiabicyclo[3.1.0]hexan-4-yl]-3H-purin-6-one Formula: C10H11N5OS MolecularWeight: 249.29224

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C1N3C=NC4=C3NC(=NC4=O)N)S2

Isomeric SMILES

C1C[C@H]2[C@@H]([C@H]1N3C=NC4=C3NC(=NC4=O)N)S2

InChI

InChI=1S/C10H11N5OS/c11-10-13-8-6(9(16)14-10)12-3-15(8)4-1-2-5-7(4)17-5/h3-5,7H,1-2H2,(H3,11,13,14,16)/t4-,5-,7+/m0/s1