1-[4-[(E)-3-methylsulfanylbut-1-enyl]phenyl]propan-1-one

Systemtic Name: 1-[4-[(E)-3-methylsulfanylbut-1-enyl]phenyl]propan-1-one Openeye Name: 1-[4-[(E)-3-methylsulfanylbut-1-enyl]phenyl]propan-1-one CAS Name: 1-[4-[(E)-3-(methylthio)but-1-enyl]phenyl]-1-propanone IUPAC Name: 1-[4-[(E)-3-methylsulfanylbut-1-enyl]phenyl]propan-1-one Traditional Name: 1-[4-[(E)-3-(methylthio)but-1-enyl]phenyl]propan-1-one Formula: C14H18OS MolecularWeight: 234.35712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)/C=C/C(C)SC

InChI

InChI=1S/C14H18OS/c1-4-14(15)13-9-7-12(8-10-13)6-5-11(2)16-3/h5-11H,4H2,1-3H3/b6-5+