3-methyl-3-(oxan-2-yl)butanethioic S-acid

Systemtic Name: 3-methyl-3-(oxan-2-yl)butanethioic S-acid Openeye Name: 3-methyl-3-tetrahydropyran-2-yl-butanethioic S-acid CAS Name: 3-methyl-3-(2-oxanyl)butanethioic S-acid IUPAC Name: 3-methyl-3-(oxan-2-yl)butanethioic S-acid Traditional Name: 3-methyl-3-tetrahydropyran-2-yl-thiobutyric acid Formula: C10H18O2S MolecularWeight: 202.31372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)S)C1CCCCO1

Isomeric SMILES

CC(C)(CC(=O)S)C1CCCCO1

InChI

InChI=1S/C10H18O2S/c1-10(2,7-9(11)13)8-5-3-4-6-12-8/h8H,3-7H2,1-2H3,(H,11,13)