1-[2-oxidanyl-1-(1H-1,2,4-triazol-5-yl)butyl]sulfanylpropane-1,3-diol

Systemtic Name: 1-[2-oxidanyl-1-(1H-1,2,4-triazol-5-yl)butyl]sulfanylpropane-1,3-diol Openeye Name: 1-[2-hydroxy-1-(1H-1,2,4-triazol-5-yl)butyl]sulfanylpropane-1,3-diol CAS Name: 1-[[2-hydroxy-1-(1H-1,2,4-triazol-5-yl)butyl]thio]propane-1,3-diol IUPAC Name: 1-[2-hydroxy-1-(1H-1,2,4-triazol-5-yl)butyl]sulfanylpropane-1,3-diol Traditional Name: 1-[[2-hydroxy-1-(1H-1,2,4-triazol-5-yl)butyl]thio]propane-1,3-diol Formula: C9H17N3O3S MolecularWeight: 247.31458

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C1=NC=NN1)SC(CCO)O)O

Isomeric SMILES

CCC(C(C1=NC=NN1)SC(CCO)O)O

InChI

InChI=1S/C9H17N3O3S/c1-2-6(14)8(9-10-5-11-12-9)16-7(15)3-4-13/h5-8,13-15H,2-4H2,1H3,(H,10,11,12)