[5-[[6-azanyl-5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]-1,3-oxathiolan-2-yl]phosphonic acid

Systemtic Name: [5-[[6-azanyl-5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]methyl]-1,3-oxathiolan-2-yl]phosphonic acid Openeye Name: [5-[(6-amino-5-methyl-2,4-dioxo-pyrimidin-1-yl)methyl]-1,3-oxathiolan-2-yl]phosphonic acid CAS Name: [5-[(6-amino-5-methyl-2,4-dioxo-1-pyrimidinyl)methyl]-1,3-oxathiolan-2-yl]phosphonic acid IUPAC Name: [5-[(6-amino-5-methyl-2,4-dioxopyrimidin-1-yl)methyl]-1,3-oxathiolan-2-yl]phosphonic acid Traditional Name: [5-[(6-amino-2,4-diketo-5-methyl-pyrimidin-1-yl)methyl]-1,3-oxathiolan-2-yl]phosphonic acid Formula: C9H14N3O6PS MolecularWeight: 323.262721

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=O)NC1=O)CC2CSC(O2)P(=O)(O)O)N

Isomeric SMILES

CC1=C(N(C(=O)NC1=O)CC2CSC(O2)P(=O)(O)O)N

InChI

InChI=1S/C9H14N3O6PS/c1-4-6(10)12(8(14)11-7(4)13)2-5-3-20-9(18-5)19(15,16)17/h5,9H,2-3,10H2,1H3,(H,11,13,14)(H2,15,16,17)