[(2S)-1-[4-(2-dimethylaminoethylamino)-5-ethyl-2-oxidanylidene-pyrimidin-1-yl]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid

Systemtic Name: [(2S)-1-[4-(2-dimethylaminoethylamino)-5-ethyl-2-oxidanylidene-pyrimidin-1-yl]-3-oxidanyl-propan-2-yl]oxymethylphosphonic acid Openeye Name: [(1S)-1-[[4-(2-dimethylaminoethylamino)-5-ethyl-2-oxo-pyrimidin-1-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid CAS Name: [(2S)-1-[4-(2-dimethylaminoethylamino)-5-ethyl-2-oxo-1-pyrimidinyl]-3-hydroxypropan-2-yl]oxymethylphosphonic acid IUPAC Name: [(2S)-1-[4-(2-dimethylaminoethylamino)-5-ethyl-2-oxopyrimidin-1-yl]-3-hydroxypropan-2-yl]oxymethylphosphonic acid Traditional Name: [(1S)-1-[[4-(2-dimethylaminoethylamino)-5-ethyl-2-keto-pyrimidin-1-yl]methyl]-2-hydroxy-ethoxy]methylphosphonic acid Formula: C14H27N4O6P MolecularWeight: 378.361141

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN(C(=O)N=C1NCCN(C)C)CC(CO)OCP(=O)(O)O

Isomeric SMILES

CCC1=CN(C(=O)N=C1NCCN(C)C)C[C@@H](CO)OCP(=O)(O)O

InChI

InChI=1S/C14H27N4O6P/c1-4-11-7-18(8-12(9-19)24-10-25(21,22)23)14(20)16-13(11)15-5-6-17(2)3/h7,12,19H,4-6,8-10H2,1-3H3,(H,15,16,20)(H2,21,22,23)/t12-/m0/s1