actinium; 1-[5-ethynyl-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-4-(1,2,4-triazol-1-yl)pyrimidin-2-one

Systemtic Name: actinium; 1-[5-ethynyl-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-4-(1,2,4-triazol-1-yl)pyrimidin-2-one Openeye Name: actinium; 1-[5-ethynyl-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-(1,2,4-triazol-1-yl)pyrimidin-2-one CAS Name: actinium; 1-[5-ethynyl-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-4-(1,2,4-triazol-1-yl)-2-pyrimidinone IUPAC Name: actinium; 1-[5-ethynyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-(1,2,4-triazol-1-yl)pyrimidin-2-one Traditional Name: actinium; 1-(5-ethynyl-4-hydroxy-5-methylol-tetrahydrofuran-2-yl)-4-(1,2,4-triazol-1-yl)pyrimidin-2-one Formula: C13H13Ac2N5O4 MolecularWeight: 757.328914

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1(C(CC(O1)N2C=CC(=NC2=O)N3C=NC=N3)O)CO.[Ac].[Ac]

Isomeric SMILES

C#CC1(C(CC(O1)N2C=CC(=NC2=O)N3C=NC=N3)O)CO.[Ac].[Ac]

InChI

InChI=1S/C13H13N5O4.2Ac/c1-2-13(6-19)9(20)5-11(22-13)17-4-3-10(16-12(17)21)18-8-14-7-15-18;;/h1,3-4,7-9,11,19-20H,5-6H2;;