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4-[2-[(5-oxidanidyl-1,2,4-triazin-3-yl)sulfanyl]ethoxy]benzoate

4-[2-[(5-oxidanidyl-1,2,4-triazin-3-yl)sulfanyl]ethoxy]benzoate

Systemtic Name:4-[2-[(5-oxidanidyl-1,2,4-triazin-3-yl)sulfanyl]ethoxy]benzoate
Openeye Name:4-[2-[(5-oxido-1,2,4-triazin-3-yl)sulfanyl]ethoxy]benzoate
CAS Name:4-[2-[(5-oxido-1,2,4-triazin-3-yl)thio]ethoxy]benzoate
IUPAC Name:4-[2-[(5-oxido-1,2,4-triazin-3-yl)sulfanyl]ethoxy]benzoate
Traditional Name:4-[2-[(5-oxido-1,2,4-triazin-3-yl)thio]ethoxy]benzoate
Formula: C12H9N3O4S-2
MolecularWeight: 291.28256
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)[O-])OCCSC2=NC(=CN=N2)[O-]


Isomeric SMILES

C1=CC(=CC=C1C(=O)[O-])OCCSC2=NC(=CN=N2)[O-]


InChI

InChI=1S/C12H11N3O4S/c16-10-7-13-15-12(14-10)20-6-5-19-9-3-1-8(2-4-9)11(17)18/h1-4,7H,5-6H2,(H,17,18)(H,14,15,16)/p-2


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