(E)-3-(3-butoxy-4-methylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one

Systemtic Name: (E)-3-(3-butoxy-4-methylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one Openeye Name: (E)-3-(3-butoxy-4-methylsulfanyl-phenyl)-1-phenyl-prop-2-en-1-one CAS Name: (E)-3-[3-butoxy-4-(methylthio)phenyl]-1-phenyl-2-propen-1-one IUPAC Name: (E)-3-(3-butoxy-4-methylsulfanylphenyl)-1-phenylprop-2-en-1-one Traditional Name: (E)-3-[3-butoxy-4-(methylthio)phenyl]-1-phenyl-prop-2-en-1-one Formula: C20H22O2S MolecularWeight: 326.45248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)C=CC(=O)C2=CC=CC=C2)SC

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)/C=C/C(=O)C2=CC=CC=C2)SC

InChI

InChI=1S/C20H22O2S/c1-3-4-14-22-19-15-16(11-13-20(19)23-2)10-12-18(21)17-8-6-5-7-9-17/h5-13,15H,3-4,14H2,1-2H3/b12-10+