4-[(5-diethoxyphosphoryl-5-oxidanylidene-pentyl)amino]-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one

Systemtic Name: 4-[(5-diethoxyphosphoryl-5-oxidanylidene-pentyl)amino]-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one Openeye Name: 4-[(5-diethoxyphosphoryl-5-oxo-pentyl)amino]-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one CAS Name: 4-[(5-diethoxyphosphoryl-5-oxopentyl)amino]-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]-2-pyrimidinone IUPAC Name: 4-[(5-diethoxyphosphoryl-5-oxopentyl)amino]-1-[2-(hydroxymethyl)-1,3-oxathiolan-5-yl]pyrimidin-2-one Traditional Name: 4-[(5-diethoxyphosphoryl-5-keto-pentyl)amino]-1-(2-methylol-1,3-oxathiolan-5-yl)pyrimidin-2-one Formula: C17H28N3O7PS MolecularWeight: 449.458881

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(=O)CCCCNC1=NC(=O)N(C=C1)C2CSC(O2)CO)OCC

Isomeric SMILES

CCOP(=O)(C(=O)CCCCNC1=NC(=O)N(C=C1)C2CSC(O2)CO)OCC

InChI

InChI=1S/C17H28N3O7PS/c1-3-25-28(24,26-4-2)15(22)7-5-6-9-18-13-8-10-20(17(23)19-13)14-12-29-16(11-21)27-14/h8,10,14,16,21H,3-7,9,11-12H2,1-2H3,(H,18,19,23)