methyl 2-[[(2R,3R,5S)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]carbonylamino]-3-methyl-pentanoate

Systemtic Name: methyl 2-[[(2R,3R,5S)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]carbonylamino]-3-methyl-pentanoate Openeye Name: methyl 2-[[(2R,3R,5S)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-carbonyl]amino]-3-methyl-pentanoate CAS Name: 2-[[[(2R,3R,5S)-5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]-oxomethyl]amino]-3-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[[(2R,3R,5S)-5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolane-2-carbonyl]amino]-3-methylpentanoate Traditional Name: 2-[[(2R,3R,5S)-5-(4-amino-2-keto-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-carbonyl]amino]-3-methyl-valeric acid methyl ester Formula: C16H24N4O6 MolecularWeight: 368.38496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)C1C(CC(O1)N2C=CC(=NC2=O)N)O

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)[C@H]1[C@@H](C[C@H](O1)N2C=CC(=NC2=O)N)O

InChI

InChI=1S/C16H24N4O6/c1-4-8(2)12(15(23)25-3)19-14(22)13-9(21)7-11(26-13)20-6-5-10(17)18-16(20)24/h5-6,8-9,11-13,21H,4,7H2,1-3H3,(H,19,22)(H2,17,18,24)/t8?,9-,11+,12?,13-/m1/s1