[(2S,5S)-5-(4-benzamido-2-oxidanylidene-pyrimidin-1-yl)-2-ethynyl-oxolan-2-yl]methyl ethanoate

Systemtic Name: [(2S,5S)-5-(4-benzamido-2-oxidanylidene-pyrimidin-1-yl)-2-ethynyl-oxolan-2-yl]methyl ethanoate Openeye Name: [(2S,5S)-5-(4-benzamido-2-oxo-pyrimidin-1-yl)-2-ethynyl-tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [(2S,5S)-5-(4-benzamido-2-oxo-1-pyrimidinyl)-2-ethynyl-2-oxolanyl]methyl ester IUPAC Name: [(2S,5S)-5-(4-benzamido-2-oxopyrimidin-1-yl)-2-ethynyloxolan-2-yl]methyl acetate Traditional Name: acetic acid [(2S,5S)-5-(4-benzamido-2-keto-pyrimidin-1-yl)-2-ethynyl-tetrahydrofuran-2-yl]methyl ester Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(CCC(O1)N2C=CC(=NC2=O)NC(=O)C3=CC=CC=C3)C#C

Isomeric SMILES

CC(=O)OC[C@]1(CC[C@H](O1)N2C=CC(=NC2=O)NC(=O)C3=CC=CC=C3)C#C

InChI

InChI=1S/C20H19N3O5/c1-3-20(13-27-14(2)24)11-9-17(28-20)23-12-10-16(22-19(23)26)21-18(25)15-7-5-4-6-8-15/h1,4-8,10,12,17H,9,11,13H2,2H3,(H,21,22,25,26)/t17-,20+/m0/s1