4-[2,3-bis(oxidanyl)propyl]-2-methyl-3H-1,2,4-triazole-5-thiolate

Systemtic Name: 4-[2,3-bis(oxidanyl)propyl]-2-methyl-3H-1,2,4-triazole-5-thiolate Openeye Name: 4-(2,3-dihydroxypropyl)-2-methyl-3H-1,2,4-triazole-5-thiolate CAS Name: 4-(2,3-dihydroxypropyl)-2-methyl-3H-1,2,4-triazole-5-thiolate IUPAC Name: 4-(2,3-dihydroxypropyl)-2-methyl-3H-1,2,4-triazole-5-thiolate Traditional Name: 4-glyceryl-2-methyl-3H-1,2,4-triazole-5-thiolate Formula: C6H12N3O2S- MolecularWeight: 190.24338

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Descriptors Computed from Structure

Canonical SMILES:

CN1CN(C(=N1)[S-])CC(CO)O

Isomeric SMILES

CN1CN(C(=N1)[S-])CC(CO)O

InChI

InChI=1S/C6H13N3O2S/c1-8-4-9(6(12)7-8)2-5(11)3-10/h5,10-11H,2-4H2,1H3,(H,7,12)/p-1