[3-azido-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methyl (2-ethoxy-3-hexadecylsulfanyl-propyl) phosphate

Systemtic Name: [3-azido-5-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]oxolan-2-yl]methyl (2-ethoxy-3-hexadecylsulfanyl-propyl) phosphate Openeye Name: [3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl (2-ethoxy-3-hexadecylsulfanyl-propyl) phosphate CAS Name: [3-azido-5-(5-methyl-2,4-dioxo-1-pyrimidinyl)-2-oxolanyl]methyl [2-ethoxy-3-(hexadecylthio)propyl] phosphate IUPAC Name: [3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl (2-ethoxy-3-hexadecylsulfanylpropyl) phosphate Traditional Name: [3-azido-5-(2,4-diketo-5-methyl-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl [3-(cetylthio)-2-ethoxy-propyl] phosphate Formula: C31H55N5O8PS- MolecularWeight: 688.835861

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC(COP(=O)([O-])OCC1C(CC(O1)N2C=C(C(=O)NC2=O)C)N=[N+]=[N-])OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC(COP(=O)([O-])OCC1C(CC(O1)N2C=C(C(=O)NC2=O)C)N=[N+]=[N-])OCC

InChI

InChI=1S/C31H56N5O8PS/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-46-24-26(41-5-2)22-42-45(39,40)43-23-28-27(34-35-32)20-29(44-28)36-21-25(3)30(37)33-31(36)38/h21,26-29H,4-20,22-24H2,1-3H3,(H,39,40)(H,33,37,38)/p-1