2-[(5-thiophen-2-yl-1,2,4-triazin-3-yl)sulfanyl]ethanoate

Systemtic Name: 2-[(5-thiophen-2-yl-1,2,4-triazin-3-yl)sulfanyl]ethanoate Openeye Name: 2-[[5-(2-thienyl)-1,2,4-triazin-3-yl]sulfanyl]acetate CAS Name: 2-[(5-thiophen-2-yl-1,2,4-triazin-3-yl)thio]acetate IUPAC Name: 2-[(5-thiophen-2-yl-1,2,4-triazin-3-yl)sulfanyl]acetate Traditional Name: 2-[[5-(2-thienyl)-1,2,4-triazin-3-yl]thio]acetate Formula: C9H6N3O2S2- MolecularWeight: 252.29284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=CN=NC(=N2)SCC(=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C2=CN=NC(=N2)SCC(=O)[O-]

InChI

InChI=1S/C9H7N3O2S2/c13-8(14)5-16-9-11-6(4-10-12-9)7-2-1-3-15-7/h1-4H,5H2,(H,13,14)/p-1