5-(2-methylpropyl)-3-(3-methylsulfanylpropanoyl)oxolane-2,4-dione

Systemtic Name: 5-(2-methylpropyl)-3-(3-methylsulfanylpropanoyl)oxolane-2,4-dione Openeye Name: 5-isobutyl-3-(3-methylsulfanylpropanoyl)tetrahydrofuran-2,4-dione CAS Name: 5-(2-methylpropyl)-3-[3-(methylthio)-1-oxopropyl]oxolane-2,4-dione IUPAC Name: 5-(2-methylpropyl)-3-(3-methylsulfanylpropanoyl)oxolane-2,4-dione Traditional Name: 5-isobutyl-3-[3-(methylthio)propanoyl]tetrahydrofuran-2,4-quinone Formula: C12H18O4S MolecularWeight: 258.33392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1C(=O)C(C(=O)O1)C(=O)CCSC

Isomeric SMILES

CC(C)CC1C(=O)C(C(=O)O1)C(=O)CCSC

InChI

InChI=1S/C12H18O4S/c1-7(2)6-9-11(14)10(12(15)16-9)8(13)4-5-17-3/h7,9-10H,4-6H2,1-3H3