2-[[5,6-bis(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl]ethanoic acid

Systemtic Name: 2-[[5,6-bis(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl]ethanoic acid Openeye Name: 2-[[5,6-bis(2-furyl)-1,2,4-triazin-3-yl]sulfanyl]acetic acid CAS Name: 2-[[5,6-bis(2-furanyl)-1,2,4-triazin-3-yl]thio]acetic acid IUPAC Name: 2-[[5,6-bis(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl]acetic acid Traditional Name: 2-[[5,6-bis(2-furyl)-1,2,4-triazin-3-yl]thio]acetic acid Formula: C13H9N3O4S MolecularWeight: 303.29326

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C2=C(N=NC(=N2)SCC(=O)O)C3=CC=CO3

Isomeric SMILES

C1=COC(=C1)C2=C(N=NC(=N2)SCC(=O)O)C3=CC=CO3

InChI

InChI=1S/C13H9N3O4S/c17-10(18)7-21-13-14-11(8-3-1-5-19-8)12(15-16-13)9-4-2-6-20-9/h1-6H,7H2,(H,17,18)