1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1,2,4-triazole-3-carbothioamide

Systemtic Name: 1-[5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-1,2,4-triazole-3-carbothioamide Openeye Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-1,2,4-triazole-3-carbothioamide CAS Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-1,2,4-triazole-3-carbothioamide IUPAC Name: 1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2,4-triazole-3-carbothioamide Traditional Name: 1-(3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl)-1,2,4-triazole-3-carbothioamide Formula: C8H12N4O4S MolecularWeight: 260.27028

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=NN1C2C(C(C(O2)CO)O)O)C(=S)N

Isomeric SMILES

C1=NC(=NN1C2C(C(C(O2)CO)O)O)C(=S)N

InChI

InChI=1S/C8H12N4O4S/c9-6(17)7-10-2-12(11-7)8-5(15)4(14)3(1-13)16-8/h2-5,8,13-15H,1H2,(H2,9,17)