4-(furan-2-ylmethylsulfanyl)-4-methyl-pentan-2-one

Systemtic Name: 4-(furan-2-ylmethylsulfanyl)-4-methyl-pentan-2-one Openeye Name: 4-(2-furylmethylsulfanyl)-4-methyl-pentan-2-one CAS Name: 4-(2-furanylmethylthio)-4-methyl-2-pentanone IUPAC Name: 4-(furan-2-ylmethylsulfanyl)-4-methylpentan-2-one Traditional Name: 4-(2-furfurylthio)-4-methyl-pentan-2-one Formula: C11H16O2S MolecularWeight: 212.30854

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(C)(C)SCC1=CC=CO1

Isomeric SMILES

CC(=O)CC(C)(C)SCC1=CC=CO1

InChI

InChI=1S/C11H16O2S/c1-9(12)7-11(2,3)14-8-10-5-4-6-13-10/h4-6H,7-8H2,1-3H3