4-methoxy-1-(3-methylphenyl)sulfanyl-butan-2-one

Systemtic Name: 4-methoxy-1-(3-methylphenyl)sulfanyl-butan-2-one Openeye Name: 4-methoxy-1-(m-tolylsulfanyl)butan-2-one CAS Name: 4-methoxy-1-[(3-methylphenyl)thio]-2-butanone IUPAC Name: 4-methoxy-1-(3-methylphenyl)sulfanylbutan-2-one Traditional Name: 4-methoxy-1-(m-tolylthio)butan-2-one Formula: C12H16O2S MolecularWeight: 224.31924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SCC(=O)CCOC

Isomeric SMILES

CC1=CC(=CC=C1)SCC(=O)CCOC

InChI

InChI=1S/C12H16O2S/c1-10-4-3-5-12(8-10)15-9-11(13)6-7-14-2/h3-5,8H,6-7,9H2,1-2H3