2-[(5-thiophen-3-yl-1H-imidazol-2-yl)sulfanyl]hexanoic acid

Systemtic Name: 2-[(5-thiophen-3-yl-1H-imidazol-2-yl)sulfanyl]hexanoic acid Openeye Name: 2-[[5-(3-thienyl)-1H-imidazol-2-yl]sulfanyl]hexanoic acid CAS Name: 2-[[5-(3-thiophenyl)-1H-imidazol-2-yl]thio]hexanoic acid IUPAC Name: 2-[(5-thiophen-3-yl-1H-imidazol-2-yl)sulfanyl]hexanoic acid Traditional Name: 2-[[5-(3-thienyl)-1H-imidazol-2-yl]thio]hexanoic acid Formula: C13H16N2O2S2 MolecularWeight: 296.40834

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)SC1=NC=C(N1)C2=CSC=C2

Isomeric SMILES

CCCCC(C(=O)O)SC1=NC=C(N1)C2=CSC=C2

InChI

InChI=1S/C13H16N2O2S2/c1-2-3-4-11(12(16)17)19-13-14-7-10(15-13)9-5-6-18-8-9/h5-8,11H,2-4H2,1H3,(H,14,15)(H,16,17)