4-methyl-2-methylidene-3-oxidanylidene-4-sulfanyl-5-thiophen-2-yl-pentanoic acid

Systemtic Name: 4-methyl-2-methylidene-3-oxidanylidene-4-sulfanyl-5-thiophen-2-yl-pentanoic acid Openeye Name: 4-methyl-2-methylene-3-oxo-4-sulfanyl-5-(2-thienyl)pentanoic acid CAS Name: 4-mercapto-4-methyl-2-methylene-3-oxo-5-thiophen-2-ylpentanoic acid IUPAC Name: 4-methyl-2-methylidene-3-oxo-4-sulfanyl-5-thiophen-2-ylpentanoic acid Traditional Name: 2-[2-mercapto-2-methyl-3-(2-thienyl)propanoyl]acrylic acid Formula: C11H12O3S2 MolecularWeight: 256.34118

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CS1)(C(=O)C(=C)C(=O)O)S

Isomeric SMILES

CC(CC1=CC=CS1)(C(=O)C(=C)C(=O)O)S

InChI

InChI=1S/C11H12O3S2/c1-7(10(13)14)9(12)11(2,15)6-8-4-3-5-16-8/h3-5,15H,1,6H2,2H3,(H,13,14)