1-(3-methoxy-4-propan-2-ylsulfanyl-phenyl)propan-2-one

Systemtic Name: 1-(3-methoxy-4-propan-2-ylsulfanyl-phenyl)propan-2-one Openeye Name: 1-(4-isopropylsulfanyl-3-methoxy-phenyl)propan-2-one CAS Name: 1-[3-methoxy-4-(propan-2-ylthio)phenyl]-2-propanone IUPAC Name: 1-(3-methoxy-4-propan-2-ylsulfanylphenyl)propan-2-one Traditional Name: 1-[4-(isopropylthio)-3-methoxy-phenyl]acetone Formula: C13H18O2S MolecularWeight: 238.34582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18O2S/c1-9(2)16-13-6-5-11(7-10(3)14)8-12(13)15-4/h5-6,8-9H,7H2,1-4H3