4-(4-imidazol-1-ylthiophen-2-yl)-3-methyl-5-oxidanylidene-hexanoic acid

Systemtic Name: 4-(4-imidazol-1-ylthiophen-2-yl)-3-methyl-5-oxidanylidene-hexanoic acid Openeye Name: 4-(4-imidazol-1-yl-2-thienyl)-3-methyl-5-oxo-hexanoic acid CAS Name: 4-[4-(1-imidazolyl)-2-thiophenyl]-3-methyl-5-oxohexanoic acid IUPAC Name: 4-(4-imidazol-1-ylthiophen-2-yl)-3-methyl-5-oxohexanoic acid Traditional Name: 4-(4-imidazol-1-yl-2-thienyl)-5-keto-3-methyl-hexanoic acid Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)C(C1=CC(=CS1)N2C=CN=C2)C(=O)C

Isomeric SMILES

CC(CC(=O)O)C(C1=CC(=CS1)N2C=CN=C2)C(=O)C

InChI

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