Molecule ID: 2817424

IUPAC Name: 2-[[5-(5-nitrofuran-2-yl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetic acid

Description: The molecule is a member of 1,3,4-oxadiazoles, a member of furans and a C-nitro compound. It derives from an acetic acid.

SMILES: O=C(O)CSc1nnc(-c2ccc([N+](=O)[O-])o2)o1

SELFIES: [O][=C][Branch1][C][O][C][S][C][=N][N][=C][Branch1][#C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][O][Ring1][Branch2][O][Ring1][=N]

InChI: InChI=1S/C8H5N3O6S/c12-6(13)3-18-8-10-9-7(17-8)4-1-2-5(16-4)11(14)15/h1-2H,3H2,(H,12,13)

Molecular Properties:
- Polar Surface Area: 161.0 Ų
- LogP: 1.1