3-[(3-methyl-2H-furan-3-yl)sulfanyl]heptan-4-one

Systemtic Name: 3-[(3-methyl-2H-furan-3-yl)sulfanyl]heptan-4-one Openeye Name: 3-[(3-methyl-2H-furan-3-yl)sulfanyl]heptan-4-one CAS Name: 3-[(3-methyl-2H-furan-3-yl)thio]-4-heptanone IUPAC Name: 3-[(3-methyl-2H-furan-3-yl)sulfanyl]heptan-4-one Traditional Name: 3-[(3-methyl-2H-furan-3-yl)thio]heptan-4-one Formula: C12H20O2S MolecularWeight: 228.351

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(CC)SC1(COC=C1)C

Isomeric SMILES

CCCC(=O)C(CC)SC1(COC=C1)C

InChI

InChI=1S/C12H20O2S/c1-4-6-10(13)11(5-2)15-12(3)7-8-14-9-12/h7-8,11H,4-6,9H2,1-3H3