4-[5-[(2-ethylimidazol-1-yl)methyl]thiophen-2-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-[(2-ethylimidazol-1-yl)methyl]thiophen-2-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-[(2-ethylimidazol-1-yl)methyl]-2-thienyl]-4-oxo-butanoic acid CAS Name: 4-[5-[(2-ethyl-1-imidazolyl)methyl]-2-thiophenyl]-4-oxobutanoic acid IUPAC Name: 4-[5-[(2-ethylimidazol-1-yl)methyl]thiophen-2-yl]-4-oxobutanoic acid Traditional Name: 4-[5-[(2-ethylimidazol-1-yl)methyl]-2-thienyl]-4-keto-butyric acid Formula: C14H16N2O3S MolecularWeight: 292.35344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CN1CC2=CC=C(S2)C(=O)CCC(=O)O

Isomeric SMILES

CCC1=NC=CN1CC2=CC=C(S2)C(=O)CCC(=O)O

InChI

InChI=1S/C14H16N2O3S/c1-2-13-15-7-8-16(13)9-10-3-5-12(20-10)11(17)4-6-14(18)19/h3,5,7-8H,2,4,6,9H2,1H3,(H,18,19)