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

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

Systemtic Name:4-[2-[(3-oxidanidyl-1,2,4-triazin-5-yl)sulfanyl]ethoxy]benzoate
Openeye Name:4-[2-[(3-oxido-1,2,4-triazin-5-yl)sulfanyl]ethoxy]benzoate
CAS Name:4-[2-[(3-oxido-1,2,4-triazin-5-yl)thio]ethoxy]benzoate
IUPAC Name:4-[2-[(3-oxido-1,2,4-triazin-5-yl)sulfanyl]ethoxy]benzoate
Traditional Name:4-[2-[(3-oxido-1,2,4-triazin-5-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=CN=NC(=N2)[O-]


Isomeric SMILES

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


InChI

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


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