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

Systemtic Name: 4-[5-(2-methylimidazol-1-yl)thiophen-2-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-(2-methylimidazol-1-yl)-2-thienyl]-4-oxo-butanoic acid CAS Name: 4-[5-(2-methyl-1-imidazolyl)-2-thiophenyl]-4-oxobutanoic acid IUPAC Name: 4-[5-(2-methylimidazol-1-yl)thiophen-2-yl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[5-(2-methylimidazol-1-yl)-2-thienyl]butyric acid Formula: C12H12N2O3S MolecularWeight: 264.30028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=C(S2)C(=O)CCC(=O)O

Isomeric SMILES

CC1=NC=CN1C2=CC=C(S2)C(=O)CCC(=O)O

InChI

InChI=1S/C12H12N2O3S/c1-8-13-6-7-14(8)11-4-3-10(18-11)9(15)2-5-12(16)17/h3-4,6-7H,2,5H2,1H3,(H,16,17)