2-[(5-oxidanidyl-6-phenyl-1,2,4-triazin-3-yl)sulfanyl]ethanoate

Systemtic Name: 2-[(5-oxidanidyl-6-phenyl-1,2,4-triazin-3-yl)sulfanyl]ethanoate Openeye Name: 2-[(5-oxido-6-phenyl-1,2,4-triazin-3-yl)sulfanyl]acetate CAS Name: 2-[(5-oxido-6-phenyl-1,2,4-triazin-3-yl)thio]acetate IUPAC Name: 2-[(5-oxido-6-phenyl-1,2,4-triazin-3-yl)sulfanyl]acetate Traditional Name: 2-[(5-oxido-6-phenyl-1,2,4-triazin-3-yl)thio]acetate Formula: C11H7N3O3S-2 MolecularWeight: 261.25658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(N=N2)SCC(=O)[O-])[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(N=N2)SCC(=O)[O-])[O-]

InChI

InChI=1S/C11H9N3O3S/c15-8(16)6-18-11-12-10(17)9(13-14-11)7-4-2-1-3-5-7/h1-5H,6H2,(H,15,16)(H,12,14,17)/p-2