6-(2-hydroxyethyl)-3-propan-2-ylsulfanyl-1,2,4-triazin-5-olate

Systemtic Name: 6-(2-hydroxyethyl)-3-propan-2-ylsulfanyl-1,2,4-triazin-5-olate Openeye Name: 6-(2-hydroxyethyl)-3-isopropylsulfanyl-1,2,4-triazin-5-olate CAS Name: 6-(2-hydroxyethyl)-3-(propan-2-ylthio)-1,2,4-triazin-5-olate IUPAC Name: 6-(2-hydroxyethyl)-3-propan-2-ylsulfanyl-1,2,4-triazin-5-olate Traditional Name: 6-(2-hydroxyethyl)-3-(isopropylthio)-1,2,4-triazin-5-olate Formula: C8H12N3O2S- MolecularWeight: 214.26478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NC(=C(N=N1)CCO)[O-]

Isomeric SMILES

CC(C)SC1=NC(=C(N=N1)CCO)[O-]

InChI

InChI=1S/C8H13N3O2S/c1-5(2)14-8-9-7(13)6(3-4-12)10-11-8/h5,12H,3-4H2,1-2H3,(H,9,11,13)/p-1