[(2S,3R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl] (2S)-2-azanyl-3-methyl-butanoate

Systemtic Name: [(2S,3R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl] (2S)-2-azanyl-3-methyl-butanoate Openeye Name: [(2S,3R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl] (2S)-2-amino-3-methyl-butanoate CAS Name: (2S)-2-amino-3-methylbutanoic acid [(2S,3R)-5-(4-amino-2-oxo-1-pyrimidinyl)-2-(hydroxymethyl)-3-oxolanyl] ester IUPAC Name: [(2S,3R)-5-(4-amino-2-oxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl] (2S)-2-amino-3-methylbutanoate Traditional Name: (2S)-2-amino-3-methyl-butyric acid [(2S,3R)-5-(4-amino-2-keto-pyrimidin-1-yl)-2-methylol-tetrahydrofuran-3-yl] ester Formula: C14H22N4O5 MolecularWeight: 326.34828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1CC(OC1CO)N2C=CC(=NC2=O)N)N

Isomeric SMILES

CC(C)[C@@H](C(=O)O[C@@H]1CC(O[C@H]1CO)N2C=CC(=NC2=O)N)N

InChI

InChI=1S/C14H22N4O5/c1-7(2)12(16)13(20)23-8-5-11(22-9(8)6-19)18-4-3-10(15)17-14(18)21/h3-4,7-9,11-12,19H,5-6,16H2,1-2H3,(H2,15,17,21)/t8-,9+,11?,12+/m1/s1