2-[2-azanyl-6-[2-(phosphonomethoxy)ethylsulfanyl]pyrimidin-4-yl]sulfanylethoxymethylphosphonic acid

Systemtic Name: 2-[2-azanyl-6-[2-(phosphonomethoxy)ethylsulfanyl]pyrimidin-4-yl]sulfanylethoxymethylphosphonic acid Openeye Name: 2-[2-amino-6-[2-(phosphonomethoxy)ethylsulfanyl]pyrimidin-4-yl]sulfanylethoxymethylphosphonic acid CAS Name: 2-[[2-amino-6-[2-(phosphonomethoxy)ethylthio]-4-pyrimidinyl]thio]ethoxymethylphosphonic acid IUPAC Name: 2-[2-amino-6-[2-(phosphonomethoxy)ethylsulfanyl]pyrimidin-4-yl]sulfanylethoxymethylphosphonic acid Traditional Name: 2-[[2-amino-6-[2-(phosphonomethoxy)ethylthio]pyrimidin-4-yl]thio]ethoxymethylphosphonic acid Formula: C10H19N3O8P2S2 MolecularWeight: 435.350682

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(N=C(N=C1SCCOCP(=O)(O)O)N)SCCOCP(=O)(O)O

Isomeric SMILES

C1=C(N=C(N=C1SCCOCP(=O)(O)O)N)SCCOCP(=O)(O)O

InChI

InChI=1S/C10H19N3O8P2S2/c11-10-12-8(24-3-1-20-6-22(14,15)16)5-9(13-10)25-4-2-21-7-23(17,18)19/h5H,1-4,6-7H2,(H2,11,12,13)(H2,14,15,16)(H2,17,18,19)