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

Systemtic Name: 3-[[5,6-bis(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl]propanoic acid Openeye Name: 3-[[5,6-bis(2-furyl)-1,2,4-triazin-3-yl]sulfanyl]propanoic acid CAS Name: 3-[[5,6-bis(2-furanyl)-1,2,4-triazin-3-yl]thio]propanoic acid IUPAC Name: 3-[[5,6-bis(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl]propanoic acid Traditional Name: 3-[[5,6-bis(2-furyl)-1,2,4-triazin-3-yl]thio]propionic acid Formula: C14H11N3O4S MolecularWeight: 317.31984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11N3O4S/c18-11(19)5-8-22-14-15-12(9-3-1-6-20-9)13(16-17-14)10-4-2-7-21-10/h1-4,6-7H,5,8H2,(H,18,19)