2-(furan-2-ylcarbonyl)-3-methyl-butanethioic S-acid

Systemtic Name: 2-(furan-2-ylcarbonyl)-3-methyl-butanethioic S-acid Openeye Name: 2-(furan-2-carbonyl)-3-methyl-butanethioic S-acid CAS Name: 2-[2-furanyl(oxo)methyl]-3-methylbutanethioic S-acid IUPAC Name: 2-(furan-2-carbonyl)-3-methylbutanethioic S-acid Traditional Name: 2-(2-furoyl)-3-methyl-thiobutyric acid Formula: C10H12O3S MolecularWeight: 212.26548

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)C1=CC=CO1)C(=O)S

Isomeric SMILES

CC(C)C(C(=O)C1=CC=CO1)C(=O)S

InChI

InChI=1S/C10H12O3S/c1-6(2)8(10(12)14)9(11)7-4-3-5-13-7/h3-6,8H,1-2H3,(H,12,14)