5-methoxy-1,1-bis(methylsulfanyl)-5-phenyl-pent-1-en-3-one

Systemtic Name: 5-methoxy-1,1-bis(methylsulfanyl)-5-phenyl-pent-1-en-3-one Openeye Name: 5-methoxy-1,1-bis(methylsulfanyl)-5-phenyl-pent-1-en-3-one CAS Name: 5-methoxy-1,1-bis(methylthio)-5-phenyl-1-penten-3-one IUPAC Name: 5-methoxy-1,1-bis(methylsulfanyl)-5-phenylpent-1-en-3-one Traditional Name: 5-methoxy-1,1-bis(methylthio)-5-phenyl-pent-1-en-3-one Formula: C14H18O2S2 MolecularWeight: 282.42152

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC(=O)C=C(SC)SC)C1=CC=CC=C1

Isomeric SMILES

COC(CC(=O)C=C(SC)SC)C1=CC=CC=C1

InChI

InChI=1S/C14H18O2S2/c1-16-13(11-7-5-4-6-8-11)9-12(15)10-14(17-2)18-3/h4-8,10,13H,9H2,1-3H3