2,4-dimethyl-2-phenylsulfanyl-pentan-3-one

Systemtic Name: 2,4-dimethyl-2-phenylsulfanyl-pentan-3-one Openeye Name: 2,4-dimethyl-2-phenylsulfanyl-pentan-3-one CAS Name: 2,4-dimethyl-2-(phenylthio)-3-pentanone IUPAC Name: 2,4-dimethyl-2-phenylsulfanylpentan-3-one Traditional Name: 2,4-dimethyl-2-(phenylthio)pentan-3-one Formula: C13H18OS MolecularWeight: 222.34642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18OS/c1-10(2)12(14)13(3,4)15-11-8-6-5-7-9-11/h5-10H,1-4H3