2-azanyl-9-[(2-oxidanyl-1,3,2-dioxaphosphinan-5-yl)oxymethyl]-3H-purine-6-thione

Systemtic Name: 2-azanyl-9-[(2-oxidanyl-1,3,2-dioxaphosphinan-5-yl)oxymethyl]-3H-purine-6-thione Openeye Name: 2-amino-9-[(2-hydroxy-1,3,2-dioxaphosphinan-5-yl)oxymethyl]-3H-purine-6-thione CAS Name: 2-amino-9-[(2-hydroxy-1,3,2-dioxaphosphorinan-5-yl)oxymethyl]-3H-purine-6-thione IUPAC Name: 2-amino-9-[(2-hydroxy-1,3,2-dioxaphosphinan-5-yl)oxymethyl]-3H-purine-6-thione Traditional Name: 2-amino-9-[(2-hydroxy-1,3,2-dioxaphosphorinan-5-yl)oxymethyl]-3H-purine-6-thione Formula: C9H12N5O4PS MolecularWeight: 317.261441

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COP(O1)O)OCN2C=NC3=C2NC(=NC3=S)N

Isomeric SMILES

C1C(COP(O1)O)OCN2C=NC3=C2NC(=NC3=S)N

InChI

InChI=1S/C9H12N5O4PS/c10-9-12-7-6(8(20)13-9)11-3-14(7)4-16-5-1-17-19(15)18-2-5/h3,5,15H,1-2,4H2,(H3,10,12,13,20)