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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC=CN1CC2=CSC(=C2)C(=O)CCC(=O)O

Isomeric SMILES

CCC1=NC=CN1CC2=CSC(=C2)C(=O)CCC(=O)O

InChI

InChI=1S/C14H16N2O3S/c1-2-13-15-5-6-16(13)8-10-7-12(20-9-10)11(17)3-4-14(18)19/h5-7,9H,2-4,8H2,1H3,(H,18,19)