4-[5-[3-(2-methylimidazol-1-yl)propyl]thiophen-2-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-[3-(2-methylimidazol-1-yl)propyl]thiophen-2-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-[3-(2-methylimidazol-1-yl)propyl]-2-thienyl]-4-oxo-butanoic acid CAS Name: 4-[5-[3-(2-methyl-1-imidazolyl)propyl]-2-thiophenyl]-4-oxobutanoic acid IUPAC Name: 4-[5-[3-(2-methylimidazol-1-yl)propyl]thiophen-2-yl]-4-oxobutanoic acid Traditional Name: 4-keto-4-[5-[3-(2-methylimidazol-1-yl)propyl]-2-thienyl]butyric acid Formula: C15H18N2O3S MolecularWeight: 306.38002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1CCCC2=CC=C(S2)C(=O)CCC(=O)O

Isomeric SMILES

CC1=NC=CN1CCCC2=CC=C(S2)C(=O)CCC(=O)O

InChI

InChI=1S/C15H18N2O3S/c1-11-16-8-10-17(11)9-2-3-12-4-6-14(21-12)13(18)5-7-15(19)20/h4,6,8,10H,2-3,5,7,9H2,1H3,(H,19,20)