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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=CN1C2=CC=C(S2)C(=O)C(C)CC(=O)O

Isomeric SMILES

CCCC1=NC=CN1C2=CC=C(S2)C(=O)C(C)CC(=O)O

InChI

InChI=1S/C15H18N2O3S/c1-3-4-12-16-7-8-17(12)13-6-5-11(21-13)15(20)10(2)9-14(18)19/h5-8,10H,3-4,9H2,1-2H3,(H,18,19)